A0A061HXJ4_CRIGR Loading...

Fibroblast growth factor

AlphaFold DB , UniProt , Accession A0A061HXJ4, Species CRIGR (Cricetulus griseus, Chinese hamster), Gene Fgf21, Length 209 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	42	Very low	42.1	Very low	238 Å²	238	151 Å²	151	100%	1.172	85%	0.851	S	S	*	*				0	119.3	0	-79.4	113.7	148.1	0	0	107.9
2	D	41.4	Very low	42.3	Very low	165 Å²	165	143 Å²	143	88%	0.882	83%	0.828	S	S	*	*			trans	35.2	112	169.6	-71.6	-79.7	0	0	0	122.8
3	W	37.9	Very low	43.2	Very low	222 Å²	222	144.5 Å²	144.5	84%	0.841	83%	0.83	S	S	*	*			trans	-101.2	129.8	159.1	179.2	-77.1	0	0	0	107.6
4	M	36.7	Very low	43.6	Very low	167 Å²	167	150.9 Å²	150.9	82%	0.823	83%	0.834	S	S	*	*				-174.4	120.9	126.7	-131.3	108.3	152.5	0	0	112.8
5	K	47.3	Very low	44.4	Very low	198 Å²	198	147.5 Å²	147.5	86%	0.861	82%	0.819	S	S	*	*			trans	-71.8	140.5	148.2	-87	173.5	165.1	-179.3	0	109.9
6	S	42.4	Very low	45	Very low	111 Å²	111	144.6 Å²	144.6	78%	0.776	81%	0.808	S	S	*	*			trans	-179.1	129.4	147.7	45.6	0	0	0	0	106.4
7	G	39.5	Very low	45.6	Very low	70 Å²	70	144.8 Å²	144.8	72%	0.722	81%	0.806	S	S	*	*			cis	106.7	98.7	33.4	0	0	0	0	0	109.3
8	V	42.9	Very low	46.2	Very low	160 Å²	160	145.2 Å²	145.2	97%	0.97	81%	0.806	S	S	*	*			trans	69	130.6	154.7	-174.5	0	0	0	0	119.1
9	G	33.9	Very low	46.3	Very low	63 Å²	63	143.1 Å²	143.1	65%	0.649	80%	0.799	S	S	*	*			trans	162.5	78.5	157.8	0	0	0	0	0	113.1	P11	G9-P11 VanDerWaalsContact O-CD 3.26Å; G9-P11 WeakPolarHBondContact O-CD 3.26Å
10	V	54.2	Low	46.8	Very low	150 Å²	150	142.4 Å²	142.4	91%	0.909	79%	0.792	S	S	*	*			trans	-78.2	124	153	176.6	0	0	0	0	106.2
11	P	45.5	Very low	47	Very low	117 Å²	117	145.3 Å²	145.3	76%	0.76	80%	0.797	S	S	*	*			trans	-132.4	142.6	147.8	36.3	-23.9	0	0	0	111.6	G9	G9-P11 VanDerWaalsContact O-CD 3.26Å; G9-P11 WeakPolarHBondContact O-CD 3.26Å
12	G	43.6	Very low	47.6	Very low	55 Å²	55	141.5 Å²	141.5	57%	0.567	78%	0.781	S	S	*	*			trans	90.3	77.8	146.2	0	0	0	0	0	115	W14	G12-W14 VanDerWaalsContact C-N 3.27Å; G12-W14 PolarHBondContact O-N 2.87Å
13	L	54.4	Low	48.3	Very low	163 Å²	163	141.1 Å²	141.1	85%	0.853	78%	0.778	S	S	*	*			trans	-47.9	91.4	146.5	-168.8	85.2	0	0	0	109.8	V15	L13-V15 HydrophobicContact CD1-CG2 4.42Å; L13-V15 HydrophobicContact CG-CG2 4.47Å
14	W	49.4	Very low	49.2	Very low	234 Å²	234	133.2 Å²	133.2	89%	0.886	77%	0.765	S	S	*	*			trans	-117.8	81	163.2	-75.5	70.5	0	0	0	106.8	G12 P16	G12-W14 VanDerWaalsContact C-N 3.27Å; G12-W14 PolarHBondContact O-N 2.87Å; W14-P16 WeakPolarHBondContact O-CD 3.21Å
15	V	55	Low	50.5	Low	100 Å²	100	130.8 Å²	130.8	61%	0.606	76%	0.759	S	S	*	*			trans	-65.5	116	161.8	178	0	0	0	0	105.9	L13 L17	L13-V15 HydrophobicContact CD1-CG2 4.42Å; L13-V15 HydrophobicContact CG-CG2 4.47Å; V15-L17 PolarHBondContact O-N 3.02Å
16	P	53.1	Low	51.3	Low	100 Å²	100	126.7 Å²	126.7	65%	0.649	76%	0.756	S	S	*	*			trans	-65.3	109.3	160.8	27.2	-29.7	0	0	0	106.5	W14 L18	W14-P16 WeakPolarHBondContact O-CD 3.21Å; P16-L18 PolarHBondContact O-N 2.77Å
17	L	56.8	Low	52.5	Low	149 Å²	149	128 Å²	128	78%	0.78	75%	0.75	S	S	*	*			trans	-66.6	64.1	167.4	-76.1	166.9	0	0	0	109.7	V15	V15-L17 PolarHBondContact O-N 3.02Å
18	L	55.1	Low	53.8	Low	152 Å²	152	129 Å²	129	80%	0.796	75%	0.752	S	S	*	*			trans	-152.6	73.3	178	-98.8	141.8	0	0	0	105.6	P16	P16-L18 PolarHBondContact O-N 2.77Å
19	P	49.4	Very low	54.9	Low	104 Å²	104	128.6 Å²	128.6	68%	0.675	74%	0.739	S	S	*	*	S	Bend		-154.4	75	94.5	38	-16.4	0	0	0	112.1
20	I	55.1	Low	56.5	Low	129 Å²	129	131.1 Å²	131.1	66%	0.662	74%	0.744	S	S	*	*	S	Bend	trans	-117.4	34.2	166.7	-42.9	177.8	0	0	0	109.9
21	F	51.5	Low	56.6	Low	205 Å²	205	131.1 Å²	131.1	90%	0.899	74%	0.737	S	S	*	*	S	Bend	trans	-129.2	21.3	171.1	-110.8	-84.9	0	0	0	112.2
22	L	54.2	Low	57.1	Low	158 Å²	158	130.4 Å²	130.4	83%	0.827	73%	0.732	S	S	*	*			trans	-127.6	24.7	172.4	-67.1	176	0	0	0	112.3	G24	L22-G24 PolarHBondContact O-N 2.77Å; L22-G24 VanDerWaalsContact O-N 3.1Å
23	L	56.2	Low	57.8	Low	156 Å²	156	133.6 Å²	133.6	82%	0.817	74%	0.737	S	S	*	*			trans	-82.4	67.9	151.4	-84.8	139	0	0	0	106.6	V25	L23-V25 PolarHBondContact O-N 3.07Å; L23-V25 VanDerWaalsContact O-N 3.07Å
24	G	56.7	Low	57.9	Low	57 Å²	57	130.7 Å²	130.7	59%	0.588	73%	0.73	S	S	*	*			trans	-55.6	115.7	160.5	0	0	0	0	0	105.8	L22 S26	L22-G24 PolarHBondContact O-N 2.77Å; L22-G24 VanDerWaalsContact O-N 3.1Å; G24-S26 PolarHBondContact O-N 2.76Å
25	V	63.4	Low	58.4	Low	115 Å²	115	121.8 Å²	121.8	70%	0.697	70%	0.703	S	S	*	*			trans	-62.6	94.3	168.5	-176	0	0	0	0	104.6	L23 Q27	L23-V25 PolarHBondContact O-N 3.07Å; L23-V25 VanDerWaalsContact O-N 3.07Å; V25-Q27 HydrophobicContact CG1-CG 4.01Å; V25-Q27 PolarHBondContact O-N 3.1Å
26	S	64	Low	58.4	Low	113 Å²	113	121.4 Å²	121.4	79%	0.79	70%	0.703	S	S	*	*			trans	-65.6	86	170.4	-62.2	0	0	0	0	106.1	G24 A28	G24-S26 PolarHBondContact O-N 2.76Å; S26-A28 PolarHBondContact O-N 2.88Å
27	Q	67.8	Low	58.1	Low	137 Å²	137	123.1 Å²	123.1	64%	0.64	71%	0.706	S	S	*	*			trans	-67.7	88	165	-66	-68.3	12.2	0	0	105.7	V25 H29	V25-Q27 HydrophobicContact CG1-CG 4.01Å; V25-Q27 PolarHBondContact O-N 3.1Å; Q27-H29 VanDerWaalsContact CB-CE1 3.49Å; Q27-H29 WeakPolarHBondContact CB-CE1 3.49Å; Q27-H29 PolarHBondContact O-N 2.84Å; Q27-H29 PolarHBondContact O-ND1 2.95Å
28	A	66.7	Low	57.8	Low	93 Å²	93	120.8 Å²	120.8	77%	0.769	69%	0.694	S	S	*	*			trans	-65	92.4	166.2	0	0	0	0	0	106.1	S26	S26-A28 PolarHBondContact O-N 2.88Å
29	H	66.4	Low	57.6	Low	151 Å²	151	116.4 Å²	116.4	70%	0.699	67%	0.669	S	S	*	*	P	Polyproline II helix	trans	-70.2	123.8	166.6	-65.9	76.1	0	0	0	105.3	Q27 I31	Q27-H29 VanDerWaalsContact CB-CE1 3.49Å; Q27-H29 WeakPolarHBondContact CB-CE1 3.49Å; Q27-H29 PolarHBondContact O-N 2.84Å; Q27-H29 PolarHBondContact O-ND1 2.95Å; H29-I31 PolarHBondContact O-N 3.16Å; H29-I31 VanDerWaalsContact O-N 3.16Å
30	P	68.6	Low	57.7	Low	116 Å²	116	117.7 Å²	117.7	75%	0.753	66%	0.664	S	S	*	*	P	Polyproline II helix	trans	-54.5	129.4	172.8	23.7	-31.6	0	0	0	107.1	P32	P30-P32 VanDerWaalsContact O-CD 3.28Å; P30-P32 WeakPolarHBondContact O-CD 3.28Å; P30-P32 VanDerWaalsContact O-N 3.08Å
31	I	54.8	Low	57.5	Low	149 Å²	149	114.8 Å²	114.8	76%	0.764	67%	0.666	S	S	*	*	P	Polyproline II helix	trans	-58.7	119.9	172.7	-63.3	172.1	0	0	0	105.1	H29 D33	H29-I31 PolarHBondContact O-N 3.16Å; H29-I31 VanDerWaalsContact O-N 3.16Å; I31-D33 PolarHBondContact O-N 3.02Å
32	P	57.2	Low	57.9	Low	102 Å²	102	107.5 Å²	107.5	66%	0.662	65%	0.649	S	S	*	*	P	Polyproline II helix	trans	-56.7	119.7	173.5	22.7	-30.7	0	0	0	106.9	P30 S34	P30-P32 VanDerWaalsContact O-CD 3.28Å; P30-P32 WeakPolarHBondContact O-CD 3.28Å; P30-P32 VanDerWaalsContact O-N 3.08Å; P32-S34 PolarHBondContact O-N 3.11Å; P32-S34 PolarHBondContact O-OG 3.13Å
33	D	56.9	Low	58.8	Low	123 Å²	123	104.1 Å²	104.1	66%	0.658	63%	0.629	S	S	*	*			trans	-61.1	103.8	-170.9	-163.7	-14.8	0	0	0	109.4	I31 S35 L38	I31-D33 PolarHBondContact O-N 3.02Å; D33-S35 PolarHBondContact OD1-N 3.09Å; D33-L38 WeakPolarHBondContact OD2-CD1 2.98Å
34	S	57.9	Low	60.2	Low	101 Å²	101	99.4 Å²	99.4	71%	0.706	61%	0.607	S	S	*	*			trans	-102	15.2	-173.2	-58.1	0	0	0	0	111.5	P32 P36	P32-S34 PolarHBondContact O-N 3.11Å; P32-S34 PolarHBondContact O-OG 3.13Å; S34-P36 VanDerWaalsContact O-CD 3.24Å; S34-P36 WeakPolarHBondContact O-CD 3.24Å
35	S	59.1	Low	61.9	Low	47 Å²	47	97.9 Å²	97.9	33%	0.329	58%	0.583	S	S	.	*			trans	-68.6	116.1	-178.7	-178.9	0	0	0	0	110.8	D33 L37 L38	D33-S35 PolarHBondContact OD1-N 3.09Å; S35-L37 PolarHBondContact O-N 2.86Å; S35-L37 VanDerWaalsContact O-N 3.12Å; S35-L37 PolarHBondContact OG-N 2.87Å; S35-L38 PolarHBondContact O-N 3.38Å
36	P	54.5	Low	63.3	Low	92 Å²	92	95.3 Å²	95.3	60%	0.597	56%	0.564	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.4	-13.1	175.5	28.2	-34.4	0	0	0	112.5	S34 Q39 F40	S34-P36 VanDerWaalsContact O-CD 3.24Å; S34-P36 WeakPolarHBondContact O-CD 3.24Å; P36-Q39 WeakPolarHBondContact O-CB 3.09Å; P36-F40 VanDerWaalsContact O-CE2 3.28Å; P36-F40 WeakPolarHBondContact O-CE2 3.28Å
37	L	46.9	Very low	64.8	Low	136 Å²	136	92.5 Å²	92.5	71%	0.712	54%	0.535	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.7	-26.7	178.5	-63.2	178.8	0	0	0	112.8	S35 Q39 F40	S35-L37 PolarHBondContact O-N 2.86Å; S35-L37 VanDerWaalsContact O-N 3.12Å; S35-L37 PolarHBondContact OG-N 2.87Å; L37-Q39 PolarHBondContact O-N 3.42Å; L37-F40 PolarHBondContact O-N 3.12Å
38	L	50.8	Low	66.1	Low	100 Å²	100	86.8 Å²	86.8	52%	0.524	51%	0.509	S	S	.	.	G	3₁₀ helix	trans	-73.7	-12.3	172.2	-70	175.4	0	0	0	112.3	D33 S35 F40 G41	D33-L38 WeakPolarHBondContact OD2-CD1 2.98Å; S35-L38 PolarHBondContact O-N 3.38Å; L38-F40 PolarHBondContact O-N 3.25Å; L38-F40 VanDerWaalsContact O-N 3.09Å; L38-G41 PolarHBondContact O-N 3.35Å; L38-G41 VanDerWaalsContact O-N 3.13Å
39	Q	50.5	Low	67.5	Low	61 Å²	61	82.4 Å²	82.4	29%	0.285	47%	0.472	S	S	.	.	G	3₁₀ helix	trans	-60	-17	169.6	177.3	163	29.8	0	0	114.1	P36 L37 Q43	P36-Q39 WeakPolarHBondContact O-CB 3.09Å; L37-Q39 PolarHBondContact O-N 3.42Å; Q39-Q43 WeakPolarHBondContact O-CB 3.48Å
40	F	51.6	Low	68.9	Low	130 Å²	130	76.8 Å²	76.8	57%	0.57	45%	0.445	S	S	*	.	G	3₁₀ helix	trans	-105.5	-6.3	-179.3	-56.3	-78.8	0	0	0	112.8	P36 L37 L38 G42	P36-F40 VanDerWaalsContact O-CE2 3.28Å; P36-F40 WeakPolarHBondContact O-CE2 3.28Å; L37-F40 PolarHBondContact O-N 3.12Å; L38-F40 PolarHBondContact O-N 3.25Å; L38-F40 VanDerWaalsContact O-N 3.09Å; F40-G42 VanDerWaalsContact C-N 3.31Å; F40-G42 PolarHBondContact O-N 2.84Å; F40-G42 VanDerWaalsContact O-N 3.11Å
41	G	51.1	Low	69.9	Low	68 Å²	68	71.3 Å²	71.3	70%	0.701	41%	0.409	S	S	*	.	S	Bend	trans	-86.5	50.6	-176.1	0	0	0	0	0	114.2	L38	L38-G41 PolarHBondContact O-N 3.35Å; L38-G41 VanDerWaalsContact O-N 3.13Å
42	G	60.5	Low	71.5	Confident	53 Å²	53	65.7 Å²	65.7	55%	0.546	38%	0.381	S	S	.	.	S	Bend	trans	96.7	12	-179.5	0	0	0	0	0	115.2	F40	F40-G42 VanDerWaalsContact C-N 3.31Å; F40-G42 PolarHBondContact O-N 2.84Å; F40-G42 VanDerWaalsContact O-N 3.11Å
43	Q	72.1	Confident	72.3	Confident	86 Å²	86	62.3 Å²	62.3	40%	0.402	36%	0.358	S	S	.	.			trans	-69.7	137.9	176.4	-170.2	170.1	-29.2	0	0	111.8	Q39 R45	Q39-Q43 WeakPolarHBondContact O-CB 3.48Å; Q43-R45 HydrophobicContact CG-CG 4.5Å
44	V	87.6	Confident	72.6	Confident	57 Å²	57	64 Å²	64	35%	0.345	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	121.8	167.6	177.9	0	0	0	0	108.3	E82 K84	V44-E82 HydrophobicContact CG1-CG 3.23Å; V44-E82 WeakPolarHBondContact CG1-OE2 3.38Å; V44-K84 HydrophobicContact CG2-CD 4.17Å; V44-K84 HydrophobicContact CG2-CG 4.2Å
45	R	90.9	Very high	72.9	Confident	26 Å²	26	66.4 Å²	66.4	10%	0.098	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	116	-178.8	-62.7	175.9	-68.4	160.7	-0.8	110	Q43 R47 L83 E125	Q43-R45 HydrophobicContact CG-CG 4.5Å; R45-R47 HydrophobicContact CB-CG 4.19Å; R45-L83 HydrophobicContact CB-CB 4.25Å; R45-L83 PolarHBondContact N-O 3.21Å; R45-L83 PolarHBondContact O-N 2.86Å; R45-E125 IonicContact CZ-OE1 2.85Å; R45-E125 IonicContact CZ-OE2 3.48Å; R45-E125 IonicContact NH1-OE1 2.79Å; R45-E125 PolarHBondContact NH1-OE1 2.83Å; R45-E125 IonicContact NH1-OE2 3.28Å; R45-E125 PolarHBondContact NH1-OE2 3.02Å; R45-E125 IonicContact NH2-OE1 3.67Å; R45-E125 PolarHBondContact NH2-OE1 2.95Å; R45-E125 IonicContact NH2-OE2 3.54Å; R45-E125 PolarHBondContact NH2-OE2 3.48Å
46	H	93.4	Very high	73.1	Confident	61 Å²	61	73 Å²	73	28%	0.282	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	118.2	170	-64.2	152.4	0	0	0	110.6	L80 L81 E82 G169	H46-L80 HydrophobicContact CB-CD1 4.16Å; H46-L81 CarbonylContact C-O 3.5Å; H46-L81 WeakPolarHBondContact CA-O 3.1Å; H46-E82 IonicContact CD2-OE2 2.68Å; H46-E82 IonicContact NE2-OE2 3.53Å; H46-E82 PolarHBondContact NE2-OE2 2.95Å; H46-G169 PolarHBondContact O-N 2.97Å; H46-G169 VanDerWaalsContact O-N 3.16Å
47	R	95.3	Very high	73.9	Confident	53 Å²	53	71.3 Å²	71.3	20%	0.2	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	153.2	-170.8	-60.7	-64.1	179.4	-124.4	13.7	111.3	R45 L81 L83 P166 V167	R45-R47 HydrophobicContact CB-CG 4.19Å; R47-L81 PolarHBondContact N-O 2.73Å; R47-L81 WeakPolarHBondContact O-CA 3.35Å; R47-L81 WeakPolarHBondContact O-CB 3.37Å; R47-L81 PolarHBondContact O-N 2.94Å; R47-L83 HydrophobicContact CB-CD1 4.29Å; R47-P166 HydrophobicContact CB-CB 4.29Å; R47-P166 HydrophobicContact CG-CB 4.14Å; R47-V167 CarbonylContact C-O 3.57Å; R47-V167 WeakPolarHBondContact CA-O 3.42Å; R47-V167 WeakPolarHBondContact CD-O 3.3Å
48	H	95.9	Very high	75.8	Confident	18 Å²	18	70.8 Å²	70.8	8%	0.083	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	127.3	159.4	-59.5	-88.3	0	0	0	107.8	Y50 R75 S79 V167	H48-Y50 PolarHBondContact O-N 3.13Å; H48-R75 HydrophobicContact CB-CG 4.49Å; H48-S79 PolarHBondContact ND1-O 3.48Å; H48-S79 PolarHBondContact ND1-OG 3.28Å; H48-V167 PolarHBondContact N-O 3.15Å; H48-V167 PolarHBondContact O-N 3Å
49	L	96.1	Very high	77.7	Confident	0 Å²	0	66.8 Å²	66.8	0%	0	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	95.3	174.6	-69.1	-178.1	0	0	0	109	H60 L61 L81 L83 I93 Y135 F164 P166	L49-H60 CarbonylContact O-C 3.52Å; L49-H60 WeakPolarHBondContact O-CA 3.39Å; L49-L61 HydrophobicContact CB-CB 4.14Å; L49-L61 PolarHBondContact O-N 3.02Å; L49-L81 HydrophobicContact CB-CD1 4.09Å; L49-L81 HydrophobicContact CD1-CD1 3.73Å; L49-L81 HydrophobicContact CG-CD1 3.77Å; L49-L83 HydrophobicContact CD2-CD2 4.28Å; L49-I93 HydrophobicContact CD1-CD1 4.26Å; L49-Y135 HydrophobicContact CD1-CD2 4.34Å; L49-Y135 HydrophobicContact CD1-CE2 3.93Å; L49-Y135 HydrophobicContact CD2-CE2 3.68Å; L49-Y135 WeakPolarHBondContact CD2-OH 3.48Å; L49-Y135 HydrophobicContact CG-CE2 4.45Å; L49-F164 HydrophobicContact CB-CB 4.31Å; L49-F164 HydrophobicContact CB-CD1 3.92Å; L49-F164 HydrophobicContact CB-CG 4.39Å; L49-F164 HydrophobicContact CD2-CB 4.3Å; L49-P166 HydrophobicContact CD2-CB 3.99Å
50	Y	94.3	Very high	79.8	Confident	34 Å²	34	64.5 Å²	64.5	13%	0.133	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	143.7	176.8	171.1	-99.5	0	0	0	110.3	H48 D52 E58 V59 H60 F164 L165	H48-Y50 PolarHBondContact O-N 3.13Å; Y50-D52 HydrophobicContact CE1-CB 4.08Å; Y50-D52 WeakPolarHBondContact CE1-OD2 3.28Å; Y50-E58 HydrophobicContact CE2-CB 4.02Å; Y50-E58 HydrophobicContact CE2-CG 4.47Å; Y50-E58 WeakPolarHBondContact OH-CG 3.49Å; Y50-V59 CarbonylContact C-O 3.51Å; Y50-V59 WeakPolarHBondContact CA-O 3.24Å; Y50-H60 AromaticContact CD2-CE1 3.8Å; Y50-H60 AromaticContact CD2-NE2 3.7Å; Y50-F164 CarbonylContact O-C 3.6Å; Y50-F164 WeakPolarHBondContact O-CA 3.4Å; Y50-L165 HydrophobicContact CD1-CB 4.06Å; Y50-L165 HydrophobicContact CD1-CD2 4.41Å; Y50-L165 PolarHBondContact N-O 2.67Å; Y50-L165 PolarHBondContact O-N 2.92Å
51	T	91.4	Very high	81.9	Confident	0 Å²	0	58.3 Å²	58.3	0%	0	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	146.7	171.5	-169	0	0	0	0	109.7	V59 L146 P161 R163 F164	T51-V59 HydrophobicContact CG2-CG2 3.43Å; T51-V59 VanDerWaalsContact CG2-CG2 3.43Å; T51-V59 PolarHBondContact N-O 3.01Å; T51-V59 PolarHBondContact O-N 2.89Å; T51-L146 HydrophobicContact CG2-CD1 3.77Å; T51-P161 HydrophobicContact CG2-CG 4.05Å; T51-P161 VanDerWaalsContact OG1-CB 3.3Å; T51-P161 WeakPolarHBondContact OG1-CB 3.17Å; T51-R163 WeakPolarHBondContact CB-O 3.19Å; T51-R163 PolarHBondContact OG1-O 3.43Å; T51-F164 HydrophobicContact CG2-CD1 4.28Å; T51-F164 HydrophobicContact CG2-CE1 4.02Å
52	D	87.2	Confident	84	Confident	32 Å²	32	55.9 Å²	55.9	17%	0.171	29%	0.287	C	S	.	.			trans	-125.8	154.1	173.6	53.9	34.2	0	0	0	110.5	Y50 T57 Y132 P161 R163	Y50-D52 HydrophobicContact CE1-CB 4.08Å; Y50-D52 WeakPolarHBondContact CE1-OD2 3.28Å; D52-T57 VanDerWaalsContact CA-O 3.23Å; D52-T57 WeakPolarHBondContact CA-O 3.43Å; D52-Y132 PolarHBondContact OD2-OH 3.08Å; D52-P161 WeakPolarHBondContact O-CB 3.01Å; D52-R163 PolarHBondContact O-NH2 2.87Å; D52-R163 IonicContact OD1-CZ 3.75Å; D52-R163 IonicContact OD1-NE 3.24Å; D52-R163 IonicContact OD1-NH2 3.86Å; D52-R163 PolarHBondContact OD1-NH2 3.37Å
53	D	73.3	Confident	85.7	Confident	31 Å²	31	53.4 Å²	53.4	17%	0.166	26%	0.26	C	S	.	.			trans	-120.4	165.1	159.5	69.7	15.2	0	0	0	110.8	Q55 E56 T57 P161	D53-Q55 PolarHBondContact O-N 3.35Å; D53-Q55 WeakPolarHBondContact OD1-CA 3.45Å; D53-Q55 WeakPolarHBondContact OD1-CB 3.25Å; D53-Q55 PolarHBondContact OD1-N 3.36Å; D53-E56 PolarHBondContact O-N 3.26Å; D53-E56 PolarHBondContact OD1-N 3.17Å; D53-T57 VanDerWaalsContact CG-CB 3.41Å; D53-T57 PolarHBondContact N-O 3.03Å; D53-T57 WeakPolarHBondContact OD1-CB 3.46Å; D53-T57 PolarHBondContact OD1-N 3.28Å; D53-T57 PolarHBondContact OD1-OG1 3.16Å; D53-T57 VanDerWaalsContact OD1-OG1 3.13Å; D53-T57 WeakPolarHBondContact OD2-CB 3.02Å; D53-T57 PolarHBondContact OD2-OG1 3.03Å; D53-P161 HydrophobicContact CB-CB 4.38Å; D53-P161 HydrophobicContact CB-CG 4.41Å
54	N	63.6	Low	86.9	Confident	158 Å²	158	54.5 Å²	54.5	85%	0.845	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.8	6.7	177.6	-61.4	-14.1	0	0	0	112.5
55	Q	63.9	Low	87.4	Confident	152 Å²	152	57.9 Å²	57.9	71%	0.71	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-117.8	24.8	-176.2	-60.1	-174.3	-14.1	0	0	111.7	D53	D53-Q55 PolarHBondContact O-N 3.35Å; D53-Q55 WeakPolarHBondContact OD1-CA 3.45Å; D53-Q55 WeakPolarHBondContact OD1-CB 3.25Å; D53-Q55 PolarHBondContact OD1-N 3.36Å
56	E	64.6	Low	87.7	Confident	185 Å²	185	61.6 Å²	61.6	86%	0.864	30%	0.295	S	S	*	.	S	Bend	trans	74.2	15.1	175.1	-50.4	179.4	173.9	0	0	115.6	D53 E58	D53-E56 PolarHBondContact O-N 3.26Å; D53-E56 PolarHBondContact OD1-N 3.17Å; E56-E58 PolarHBondContact O-N 3.07Å
57	T	71.3	Confident	87.9	Confident	57 Å²	57	59.1 Å²	59.1	35%	0.35	29%	0.286	S	S	.	.			trans	-84	91.9	175.9	-51.4	0	0	0	0	110.8	D52 D53 V59	D52-T57 VanDerWaalsContact CA-O 3.23Å; D52-T57 WeakPolarHBondContact CA-O 3.43Å; D53-T57 VanDerWaalsContact CG-CB 3.41Å; D53-T57 PolarHBondContact N-O 3.03Å; D53-T57 WeakPolarHBondContact OD1-CB 3.46Å; D53-T57 PolarHBondContact OD1-N 3.28Å; D53-T57 PolarHBondContact OD1-OG1 3.16Å; D53-T57 VanDerWaalsContact OD1-OG1 3.13Å; D53-T57 WeakPolarHBondContact OD2-CB 3.02Å; D53-T57 PolarHBondContact OD2-OG1 3.03Å; T57-V59 HydrophobicContact CG2-CG1 3.84Å; T57-V59 HydrophobicContact CG2-CG2 4.24Å
58	E	87	Confident	87.9	Confident	125 Å²	125	59.6 Å²	59.6	58%	0.584	30%	0.295	S	S	*	.			trans	-94.8	108.4	170.9	-63.2	-171.2	172.4	0	0	110.6	Y50 E56	Y50-E58 HydrophobicContact CE2-CB 4.02Å; Y50-E58 HydrophobicContact CE2-CG 4.47Å; Y50-E58 WeakPolarHBondContact OH-CG 3.49Å; E56-E58 PolarHBondContact O-N 3.07Å
59	V	91.1	Very high	87.9	Confident	15 Å²	15	59 Å²	59	9%	0.091	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	155.9	-176.8	-61.7	0	0	0	0	113.5	Y50 T51 T57 T72 L146	Y50-V59 CarbonylContact C-O 3.51Å; Y50-V59 WeakPolarHBondContact CA-O 3.24Å; T51-V59 HydrophobicContact CG2-CG2 3.43Å; T51-V59 VanDerWaalsContact CG2-CG2 3.43Å; T51-V59 PolarHBondContact N-O 3.01Å; T51-V59 PolarHBondContact O-N 2.89Å; T57-V59 HydrophobicContact CG2-CG1 3.84Å; T57-V59 HydrophobicContact CG2-CG2 4.24Å; V59-T72 CarbonylContact C-O 3.44Å; V59-T72 VanDerWaalsContact CA-O 3.25Å; V59-T72 WeakPolarHBondContact CA-O 3.4Å; V59-L146 HydrophobicContact CG2-CD1 3.73Å
60	H	93.6	Very high	87.7	Confident	13 Å²	13	60.8 Å²	60.8	6%	0.06	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	141.1	172.8	-56.3	78.5	0	0	0	109.1	L49 Y50 E62 G71 T72 R75	L49-H60 CarbonylContact O-C 3.52Å; L49-H60 WeakPolarHBondContact O-CA 3.39Å; Y50-H60 AromaticContact CD2-CE1 3.8Å; Y50-H60 AromaticContact CD2-NE2 3.7Å; H60-E62 PolarHBondContact O-N 2.92Å; H60-G71 WeakPolarHBondContact O-CA 3.22Å; H60-T72 HydrophobicContact CB-CG2 4.11Å; H60-T72 PolarHBondContact N-O 3.32Å; H60-T72 WeakPolarHBondContact O-CG2 3.15Å; H60-T72 PolarHBondContact O-N 3.29Å; H60-R75 WeakPolarHBondContact NE2-CG 3.23Å; H60-R75 PolarHBondContact NE2-NE 2.91Å
61	L	95.2	Very high	87.6	Confident	0 Å²	0	59.7 Å²	59.7	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67	125.5	172.8	-170.7	153.7	0	0	0	109.9	L49 I63 V69 S79 L81 L102 L146 F164	L49-L61 HydrophobicContact CB-CB 4.14Å; L49-L61 PolarHBondContact O-N 3.02Å; L61-I63 HydrophobicContact CD2-CD1 4.26Å; L61-I63 HydrophobicContact CD2-CG1 3.72Å; L61-V69 HydrophobicContact CD1-CG1 4.41Å; L61-V69 HydrophobicContact CD2-CG1 4.13Å; L61-V69 HydrophobicContact CG-CG1 4.13Å; L61-S79 WeakPolarHBondContact O-CA 3.29Å; L61-S79 WeakPolarHBondContact O-CB 3.3Å; L61-L81 HydrophobicContact CB-CD1 4.26Å; L61-L81 HydrophobicContact CD2-CD1 3.69Å; L61-L81 HydrophobicContact CD2-CD2 4.17Å; L61-L81 HydrophobicContact CG-CD1 4.45Å; L61-L102 HydrophobicContact CD1-CD2 3.84Å; L61-L102 HydrophobicContact CD2-CD2 4.38Å; L61-L146 HydrophobicContact CB-CD2 4.14Å; L61-L146 HydrophobicContact CD1-CD2 3.85Å; L61-L146 HydrophobicContact CG-CD2 3.79Å; L61-F164 HydrophobicContact CD1-CE1 4.48Å
62	E	95.4	Very high	87.5	Confident	18 Å²	18	61 Å²	61	8%	0.084	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	134	177.1	-176.6	176.6	105.2	0	0	110.3	H60 R64 V69 I70 T72 S76 E78	H60-E62 PolarHBondContact O-N 2.92Å; E62-R64 HydrophobicContact CG-CG 4.44Å; E62-R64 IonicContact OE1-NE 2.67Å; E62-R64 PolarHBondContact OE1-NE 2.94Å; E62-V69 WeakPolarHBondContact O-CA 3.38Å; E62-I70 HydrophobicContact CB-CG1 4.15Å; E62-I70 PolarHBondContact N-O 3.24Å; E62-I70 PolarHBondContact O-N 3.16Å; E62-T72 HydrophobicContact CB-CG2 3.92Å; E62-S76 PolarHBondContact OE2-OG 2.9Å; E62-E78 HydrophobicContact CG-CB 3.5Å
63	I	97.7	Very high	87.6	Confident	0 Å²	0	63.2 Å²	63.2	0%	0	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	116.8	171.8	-51.4	178.8	0	0	0	107.7	L61 V69 E78 L81 A98 R100 L102	L61-I63 HydrophobicContact CD2-CD1 4.26Å; L61-I63 HydrophobicContact CD2-CG1 3.72Å; I63-V69 HydrophobicContact CG1-CG2 4.36Å; I63-E78 PolarHBondContact N-O 3.41Å; I63-L81 HydrophobicContact CD1-CD2 3.85Å; I63-L81 HydrophobicContact CG1-CD2 4.05Å; I63-A98 HydrophobicContact CG2-CB 4.27Å; I63-A98 WeakPolarHBondContact O-CB 3.44Å; I63-R100 HydrophobicContact CG2-CB 4.01Å; I63-L102 HydrophobicContact CD1-CB 3.87Å; I63-L102 HydrophobicContact CD1-CD1 4.3Å
64	R	96.8	Very high	88.3	Confident	110 Å²	110	68.4 Å²	68.4	42%	0.415	35%	0.347	S	S	.	.			trans	-84.9	162.6	-179.1	-70.2	-177.7	171.9	-169.3	-0.9	112.1	E62 D66 G67 T68 I70	E62-R64 HydrophobicContact CG-CG 4.44Å; E62-R64 IonicContact OE1-NE 2.67Å; E62-R64 PolarHBondContact OE1-NE 2.94Å; R64-D66 WeakPolarHBondContact CB-OD1 3.41Å; R64-D66 PolarHBondContact O-N 2.92Å; R64-G67 PolarHBondContact O-N 3.15Å; R64-T68 PolarHBondContact N-O 3.12Å; R64-I70 VanDerWaalsContact CZ-CD1 3.44Å
65	Q	97.2	Very high	89.6	Confident	128 Å²	128	67.1 Å²	67.1	60%	0.598	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	-24.2	-179.6	-68.5	-173.5	0.7	0	0	113.9	G67 R100	Q65-G67 VanDerWaalsContact C-N 3.28Å; Q65-R100 PolarHBondContact O-NE 3.22Å; Q65-R100 PolarHBondContact O-NH2 2.78Å
66	D	97.1	Very high	90.9	Very high	103 Å²	103	60.9 Å²	60.9	55%	0.551	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.3	-10.4	174.2	64	-12.8	0	0	0	112.9	R64 T68	R64-D66 WeakPolarHBondContact CB-OD1 3.41Å; R64-D66 PolarHBondContact O-N 2.92Å; D66-T68 WeakPolarHBondContact OD1-CB 3.45Å; D66-T68 PolarHBondContact OD1-N 2.97Å; D66-T68 PolarHBondContact OD1-OG1 3.45Å; D66-T68 PolarHBondContact OD2-OG1 2.7Å
67	G	97.1	Very high	92.3	Very high	10 Å²	10	56 Å²	56	10%	0.103	29%	0.288	C	S	.	.	S	Bend	trans	93.1	2.9	-175.6	0	0	0	0	0	114.1	R64 Q65 G112	R64-G67 PolarHBondContact O-N 3.15Å; Q65-G67 VanDerWaalsContact C-N 3.28Å; G67-G112 WeakPolarHBondContact CA-O 3.46Å; G67-G112 PolarHBondContact O-N 3.07Å
68	T	96.4	Very high	93.5	Very high	62 Å²	62	55.8 Å²	55.8	38%	0.38	28%	0.283	S	S	.	.	B	Isolated β-bridge	trans	-71.8	135.6	174.8	-53.9	0	0	0	0	110.2	R64 D66 I70	R64-T68 PolarHBondContact N-O 3.12Å; D66-T68 WeakPolarHBondContact OD1-CB 3.45Å; D66-T68 PolarHBondContact OD1-N 2.97Å; D66-T68 PolarHBondContact OD1-OG1 3.45Å; D66-T68 PolarHBondContact OD2-OG1 2.7Å; T68-I70 HydrophobicContact CG2-CG2 3.85Å
69	V	95.8	Very high	93.9	Very high	7 Å²	7	49.8 Å²	49.8	4%	0.042	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	122.9	176.3	-179.4	0	0	0	0	109.4	L61 E62 I63 L102 L110 L146	L61-V69 HydrophobicContact CD1-CG1 4.41Å; L61-V69 HydrophobicContact CD2-CG1 4.13Å; L61-V69 HydrophobicContact CG-CG1 4.13Å; E62-V69 WeakPolarHBondContact O-CA 3.38Å; I63-V69 HydrophobicContact CG1-CG2 4.36Å; V69-L102 HydrophobicContact CB-CD1 4.42Å; V69-L102 HydrophobicContact CG1-CD1 3.91Å; V69-L102 HydrophobicContact CG2-CD1 3.7Å; V69-L110 HydrophobicContact CB-CB 4.02Å; V69-L110 HydrophobicContact CG1-CB 3.98Å; V69-L110 HydrophobicContact CG1-CD1 4.24Å; V69-L110 HydrophobicContact CG2-CB 4.32Å; V69-L146 HydrophobicContact CG1-CD2 4.42Å
70	I	92.4	Very high	94.2	Very high	36 Å²	36	50.6 Å²	50.6	19%	0.185	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	168.3	-177.3	63	166.6	0	0	0	111.9	E62 R64 T68	E62-I70 HydrophobicContact CB-CG1 4.15Å; E62-I70 PolarHBondContact N-O 3.24Å; E62-I70 PolarHBondContact O-N 3.16Å; R64-I70 VanDerWaalsContact CZ-CD1 3.44Å; T68-I70 HydrophobicContact CG2-CG2 3.85Å
71	G	91.2	Very high	94.4	Very high	12 Å²	12	50 Å²	50	12%	0.124	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	134.7	163.3	0	0	0	0	0	112.1	H60	H60-G71 WeakPolarHBondContact O-CA 3.22Å
72	T	89.8	Confident	94.4	Very high	27 Å²	27	51.8 Å²	51.8	17%	0.166	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	140.9	173.4	-176.6	0	0	0	0	111.3	V59 H60 E62 H74	V59-T72 CarbonylContact C-O 3.44Å; V59-T72 VanDerWaalsContact CA-O 3.25Å; V59-T72 WeakPolarHBondContact CA-O 3.4Å; H60-T72 HydrophobicContact CB-CG2 4.11Å; H60-T72 PolarHBondContact N-O 3.32Å; H60-T72 WeakPolarHBondContact O-CG2 3.15Å; H60-T72 PolarHBondContact O-N 3.29Å; E62-T72 HydrophobicContact CB-CG2 3.92Å; T72-H74 VanDerWaalsContact C-N 3.3Å; T72-H74 WeakPolarHBondContact CG2-O 3.4Å; T72-H74 PolarHBondContact O-N 2.8Å; T72-H74 PolarHBondContact OG1-O 3.39Å
73	T	89.8	Confident	94.5	Very high	78 Å²	78	51 Å²	51	48%	0.479	26%	0.26	S	S	.	.	S	Bend	trans	-70.7	-27.1	-178.5	51.6	0	0	0	0	112.7
74	H	87.4	Confident	94.3	Very high	141 Å²	141	55 Å²	55	65%	0.653	28%	0.277	S	S	*	.	S	Bend	trans	-116.7	147.1	-176.4	-57.4	-64.6	0	0	0	111.4	T72 S76	T72-H74 VanDerWaalsContact C-N 3.3Å; T72-H74 WeakPolarHBondContact CG2-O 3.4Å; T72-H74 PolarHBondContact O-N 2.8Å; T72-H74 PolarHBondContact OG1-O 3.39Å; H74-S76 PolarHBondContact O-N 3.08Å
75	R	91.4	Very high	94.2	Very high	130 Å²	130	51.6 Å²	51.6	49%	0.491	27%	0.273	S	S	.	.			trans	-62.8	135.6	169.7	-64.5	-178.3	-166.9	162.1	15.4	109.5	H48 H60 V167	H48-R75 HydrophobicContact CB-CG 4.49Å; H60-R75 WeakPolarHBondContact NE2-CG 3.23Å; H60-R75 PolarHBondContact NE2-NE 2.91Å; R75-V167 VanDerWaalsContact NH2-CG1 3.33Å
76	S	91.2	Very high	94	Very high	22 Å²	22	48.8 Å²	48.8	15%	0.154	26%	0.262	C	S	.	.			trans	-136.6	158.2	-176.3	58.2	0	0	0	0	108.3	E62 H74 E78 S79 L80	E62-S76 PolarHBondContact OE2-OG 2.9Å; H74-S76 PolarHBondContact O-N 3.08Å; S76-E78 PolarHBondContact O-N 3.46Å; S76-S79 PolarHBondContact N-OG 2.85Å; S76-S79 PolarHBondContact O-N 2.91Å; S76-S79 VanDerWaalsContact O-N 3.1Å; S76-S79 PolarHBondContact O-OG 2.8Å; S76-S79 WeakPolarHBondContact OG-CB 3.36Å; S76-S79 PolarHBondContact OG-N 2.68Å; S76-S79 VanDerWaalsContact OG-N 3.15Å; S76-S79 PolarHBondContact OG-OG 2.85Å; S76-L80 PolarHBondContact O-N 2.93Å
77	P	93.8	Very high	93.8	Very high	82 Å²	82	48.7 Å²	48.7	53%	0.532	26%	0.256	S	S	.	.	G	3₁₀ helix	trans	-53.5	-33.7	170	-26.5	35.5	0	0	0	113	L80 K97	P77-L80 WeakPolarHBondContact O-CB 3.23Å; P77-L80 PolarHBondContact O-N 3.21Å; P77-K97 HydrophobicContact CB-CB 4.32Å; P77-K97 HydrophobicContact CB-CD 4.47Å; P77-K97 HydrophobicContact CB-CG 4.15Å; P77-K97 VanDerWaalsContact O-CB 3.27Å; P77-K97 WeakPolarHBondContact O-CB 3.42Å
78	E	95.6	Very high	93.5	Very high	52 Å²	52	54.4 Å²	54.4	24%	0.243	29%	0.292	C	S	.	.	G	3₁₀ helix	trans	-74.4	-21	179.7	-64.9	72.9	-161	0	0	113.5	E62 I63 S76 K97	E62-E78 HydrophobicContact CG-CB 3.5Å; I63-E78 PolarHBondContact N-O 3.41Å; S76-E78 PolarHBondContact O-N 3.46Å; E78-K97 HydrophobicContact CG-CG 4.18Å
79	S	96	Very high	93.2	Very high	0 Å²	0	53.8 Å²	53.8	0%	0	30%	0.298	C	S	.	.	G	3₁₀ helix	trans	-93.6	5	172.8	56.2	0	0	0	0	113.7	H48 L61 S76 L81	H48-S79 PolarHBondContact ND1-O 3.48Å; H48-S79 PolarHBondContact ND1-OG 3.28Å; L61-S79 WeakPolarHBondContact O-CA 3.29Å; L61-S79 WeakPolarHBondContact O-CB 3.3Å; S76-S79 PolarHBondContact N-OG 2.85Å; S76-S79 PolarHBondContact O-N 2.91Å; S76-S79 VanDerWaalsContact O-N 3.1Å; S76-S79 PolarHBondContact O-OG 2.8Å; S76-S79 WeakPolarHBondContact OG-CB 3.36Å; S76-S79 PolarHBondContact OG-N 2.68Å; S76-S79 VanDerWaalsContact OG-N 3.15Å; S76-S79 PolarHBondContact OG-OG 2.85Å; S79-L81 PolarHBondContact O-N 2.92Å
80	L	96.8	Very high	93.2	Very high	31 Å²	31	53.5 Å²	53.5	16%	0.162	30%	0.296	C	S	.	.			trans	-79.5	117.2	169.3	-174.7	65.1	0	0	0	109.9	H46 S76 P77 V96	H46-L80 HydrophobicContact CB-CD1 4.16Å; S76-L80 PolarHBondContact O-N 2.93Å; P77-L80 WeakPolarHBondContact O-CB 3.23Å; P77-L80 PolarHBondContact O-N 3.21Å; L80-V96 HydrophobicContact CD2-CB 4.39Å; L80-V96 HydrophobicContact CD2-CG2 4.4Å; L80-V96 HydrophobicContact CG-CB 4.43Å; L80-V96 HydrophobicContact CG-CG2 4.18Å; L80-V96 PolarHBondContact O-N 3.05Å
81	L	97.8	Very high	93.4	Very high	0 Å²	0	52 Å²	52	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	141.1	-176.1	-52.1	176.5	0	0	0	110.8	H46 R47 L49 L61 I63 S79 L83 I93 L94	H46-L81 CarbonylContact C-O 3.5Å; H46-L81 WeakPolarHBondContact CA-O 3.1Å; R47-L81 PolarHBondContact N-O 2.73Å; R47-L81 WeakPolarHBondContact O-CA 3.35Å; R47-L81 WeakPolarHBondContact O-CB 3.37Å; R47-L81 PolarHBondContact O-N 2.94Å; L49-L81 HydrophobicContact CB-CD1 4.09Å; L49-L81 HydrophobicContact CD1-CD1 3.73Å; L49-L81 HydrophobicContact CG-CD1 3.77Å; L61-L81 HydrophobicContact CB-CD1 4.26Å; L61-L81 HydrophobicContact CD2-CD1 3.69Å; L61-L81 HydrophobicContact CD2-CD2 4.17Å; L61-L81 HydrophobicContact CG-CD1 4.45Å; I63-L81 HydrophobicContact CD1-CD2 3.85Å; I63-L81 HydrophobicContact CG1-CD2 4.05Å; S79-L81 PolarHBondContact O-N 2.92Å; L81-L83 HydrophobicContact CB-CD1 3.83Å; L81-I93 HydrophobicContact CB-CG2 4.08Å; L81-I93 HydrophobicContact CD1-CG2 4.01Å; L81-I93 HydrophobicContact CG-CG2 4.43Å; L81-L94 CarbonylContact C-O 3.58Å; L81-L94 WeakPolarHBondContact CA-O 3.21Å
82	E	96.6	Very high	93.7	Very high	39 Å²	39	52.5 Å²	52.5	18%	0.182	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	114.6	169.9	-179.7	173.3	123.3	0	0	109.8	V44 H46 I93 L94 V96	V44-E82 HydrophobicContact CG1-CG 3.23Å; V44-E82 WeakPolarHBondContact CG1-OE2 3.38Å; H46-E82 IonicContact CD2-OE2 2.68Å; H46-E82 IonicContact NE2-OE2 3.53Å; H46-E82 PolarHBondContact NE2-OE2 2.95Å; E82-I93 CarbonylContact O-C 3.52Å; E82-I93 WeakPolarHBondContact O-CA 3.38Å; E82-L94 HydrophobicContact CB-CB 4.16Å; E82-L94 PolarHBondContact N-O 3.46Å; E82-L94 PolarHBondContact O-N 2.82Å; E82-V96 HydrophobicContact CB-CG2 3.92Å
83	L	96	Very high	94.1	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	115.1	175.5	-77.5	62.8	0	0	0	108.1	R45 R47 L49 L81 I91 I93 Y135	R45-L83 HydrophobicContact CB-CB 4.25Å; R45-L83 PolarHBondContact N-O 3.21Å; R45-L83 PolarHBondContact O-N 2.86Å; R47-L83 HydrophobicContact CB-CD1 4.29Å; L49-L83 HydrophobicContact CD2-CD2 4.28Å; L81-L83 HydrophobicContact CB-CD1 3.83Å; L83-I91 HydrophobicContact CB-CD1 4.23Å; L83-I91 HydrophobicContact CD2-CD1 4.03Å; L83-I91 HydrophobicContact CG-CD1 3.92Å; L83-I93 HydrophobicContact CD1-CG2 4.33Å; L83-I93 HydrophobicContact CG-CG1 4.29Å; L83-Y135 HydrophobicContact CD2-CE1 4.3Å
84	K	94.4	Very high	94.5	Very high	84 Å²	84	49.1 Å²	49.1	37%	0.365	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	131.7	-179.3	-178.6	-178.4	-179.5	-178.5	0	110.2	V44 I91 Q92	V44-K84 HydrophobicContact CG2-CD 4.17Å; V44-K84 HydrophobicContact CG2-CG 4.2Å; K84-I91 CarbonylContact O-C 3.53Å; K84-I91 VanDerWaalsContact O-CA 3.23Å; K84-I91 WeakPolarHBondContact O-CA 3.15Å; K84-I91 WeakPolarHBondContact O-CB 3.45Å; K84-Q92 HydrophobicContact CB-CG 3.83Å; K84-Q92 PolarHBondContact N-O 2.75Å; K84-Q92 VanDerWaalsContact N-O 3.08Å; K84-Q92 WeakPolarHBondContact O-CG 3.32Å; K84-Q92 PolarHBondContact O-N 2.71Å
85	A	93.8	Very high	95	Very high	39 Å²	39	42.4 Å²	42.4	32%	0.322	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.6	132.2	175.9	0	0	0	0	0	111.1
86	L	93.2	Very high	95.3	Very high	70 Å²	70	38.8 Å²	38.8	37%	0.366	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	-41.5	169.1	-64.4	172.4	0	0	0	110.2	V90 Q92 F116 S122	L86-V90 HydrophobicContact CD1-CG1 4.34Å; L86-V90 PolarHBondContact N-O 3.19Å; L86-Q92 HydrophobicContact CD1-CB 4.19Å; L86-Q92 HydrophobicContact CD2-CB 4.15Å; L86-Q92 HydrophobicContact CD2-CG 4Å; L86-Q92 HydrophobicContact CG-CB 4.18Å; L86-Q92 HydrophobicContact CG-CG 4.28Å; L86-F116 HydrophobicContact CD1-CE2 4.16Å; L86-F116 HydrophobicContact CD1-CZ 3.63Å; L86-F116 HydrophobicContact CD2-CZ 4.02Å; L86-F116 HydrophobicContact CG-CZ 4.49Å; L86-S122 WeakPolarHBondContact CD1-OG 3.26Å
87	K	92.6	Very high	95.6	Very high	100 Å²	100	43.1 Å²	43.1	44%	0.435	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.6	171.1	176.8	61.3	-175.4	178.7	-164.6	0	108.5	G89 V90 E138	K87-G89 PolarHBondContact O-N 3.11Å; K87-G89 VanDerWaalsContact O-N 3.13Å; K87-V90 HydrophobicContact CD-CG2 4.43Å; K87-V90 HydrophobicContact CG-CB 3.75Å; K87-V90 HydrophobicContact CG-CG2 3.98Å; K87-V90 PolarHBondContact N-O 2.75Å; K87-V90 PolarHBondContact O-N 3.16Å; K87-E138 WeakPolarHBondContact CE-OE1 3.33Å; K87-E138 VanDerWaalsContact CE-OE2 3.28Å; K87-E138 WeakPolarHBondContact CE-OE2 3.43Å; K87-E138 IonicContact NZ-OE1 3.83Å; K87-E138 PolarHBondContact NZ-OE1 2.75Å; K87-E138 IonicContact NZ-OE2 3.57Å; K87-E138 PolarHBondContact NZ-OE2 3.41Å
88	P	90.8	Very high	95.7	Very high	131 Å²	131	39.9 Å²	39.9	85%	0.851	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-51.6	123.3	-177.9	-29.2	37	0	0	0	112.7	V90	P88-V90 PolarHBondContact O-N 3.43Å
89	G	90.4	Very high	95.9	Very high	49 Å²	49	41.3 Å²	41.3	51%	0.505	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	73.3	-0.1	179.6	0	0	0	0	0	116.1	K87 R124 E125	K87-G89 PolarHBondContact O-N 3.11Å; K87-G89 VanDerWaalsContact O-N 3.13Å; G89-R124 CarbonylContact O-C 3.56Å; G89-R124 VanDerWaalsContact O-CA 3.29Å; G89-R124 WeakPolarHBondContact O-CA 3.13Å; G89-E125 PolarHBondContact O-N 3.49Å
90	V	96.2	Very high	96	Very high	0 Å²	0	44 Å²	44	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	131.3	178	-175.3	0	0	0	0	110.4	L86 K87 P88 F123 R124 E138	L86-V90 HydrophobicContact CD1-CG1 4.34Å; L86-V90 PolarHBondContact N-O 3.19Å; K87-V90 HydrophobicContact CD-CG2 4.43Å; K87-V90 HydrophobicContact CG-CB 3.75Å; K87-V90 HydrophobicContact CG-CG2 3.98Å; K87-V90 PolarHBondContact N-O 2.75Å; K87-V90 PolarHBondContact O-N 3.16Å; P88-V90 PolarHBondContact O-N 3.43Å; V90-F123 CarbonylContact C-O 3.57Å; V90-F123 VanDerWaalsContact CA-O 3.3Å; V90-F123 WeakPolarHBondContact CA-O 3.28Å; V90-R124 HydrophobicContact CG2-CG 4.14Å; V90-E138 WeakPolarHBondContact CG1-OE2 3.34Å
91	I	96.6	Very high	96.1	Very high	4 Å²	4	44.2 Å²	44.2	2%	0.021	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	157.3	-175.1	69.4	166.3	0	0	0	111.7	L83 K84 I93 F123 E125 Y135	L83-I91 HydrophobicContact CB-CD1 4.23Å; L83-I91 HydrophobicContact CD2-CD1 4.03Å; L83-I91 HydrophobicContact CG-CD1 3.92Å; K84-I91 CarbonylContact O-C 3.53Å; K84-I91 VanDerWaalsContact O-CA 3.23Å; K84-I91 WeakPolarHBondContact O-CA 3.15Å; K84-I91 WeakPolarHBondContact O-CB 3.45Å; I91-I93 HydrophobicContact CD1-CD1 4.08Å; I91-I93 HydrophobicContact CD1-CG1 3.75Å; I91-I93 HydrophobicContact CG1-CG1 4.22Å; I91-F123 HydrophobicContact CG1-CB 4.46Å; I91-F123 PolarHBondContact N-O 2.73Å; I91-F123 PolarHBondContact O-N 3.26Å; I91-E125 HydrophobicContact CD1-CB 4.45Å; I91-E125 HydrophobicContact CG2-CB 4.45Å; I91-Y135 HydrophobicContact CD1-CD1 3.72Å; I91-Y135 HydrophobicContact CD1-CE1 3.45Å; I91-Y135 VanDerWaalsContact CD1-CE1 3.45Å; I91-Y135 HydrophobicContact CG1-CD1 4.37Å; I91-Y135 HydrophobicContact CG1-CE1 4.49Å
92	Q	97.4	Very high	96.1	Very high	24 Å²	24	44.2 Å²	44.2	11%	0.112	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	151.7	156.2	57.4	171.5	85.6	0	0	108.9	K84 L86 F116	K84-Q92 HydrophobicContact CB-CG 3.83Å; K84-Q92 PolarHBondContact N-O 2.75Å; K84-Q92 VanDerWaalsContact N-O 3.08Å; K84-Q92 WeakPolarHBondContact O-CG 3.32Å; K84-Q92 PolarHBondContact O-N 2.71Å; L86-Q92 HydrophobicContact CD1-CB 4.19Å; L86-Q92 HydrophobicContact CD2-CB 4.15Å; L86-Q92 HydrophobicContact CD2-CG 4Å; L86-Q92 HydrophobicContact CG-CB 4.18Å; L86-Q92 HydrophobicContact CG-CG 4.28Å; Q92-F116 HydrophobicContact CB-CD2 4.32Å; Q92-F116 HydrophobicContact CB-CE2 3.77Å
93	I	98.4	Very high	96.2	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	122.1	175.6	-58.7	170.2	0	0	0	107.6	L49 L81 E82 L83 I91 F101 L102 F123 Y135 L144	L49-I93 HydrophobicContact CD1-CD1 4.26Å; L81-I93 HydrophobicContact CB-CG2 4.08Å; L81-I93 HydrophobicContact CD1-CG2 4.01Å; L81-I93 HydrophobicContact CG-CG2 4.43Å; E82-I93 CarbonylContact O-C 3.52Å; E82-I93 WeakPolarHBondContact O-CA 3.38Å; L83-I93 HydrophobicContact CD1-CG2 4.33Å; L83-I93 HydrophobicContact CG-CG1 4.29Å; I91-I93 HydrophobicContact CD1-CD1 4.08Å; I91-I93 HydrophobicContact CD1-CG1 3.75Å; I91-I93 HydrophobicContact CG1-CG1 4.22Å; I93-F101 CarbonylContact O-C 3.57Å; I93-F101 WeakPolarHBondContact O-CA 3.4Å; I93-L102 HydrophobicContact CB-CB 3.99Å; I93-L102 HydrophobicContact CB-CD2 4.34Å; I93-L102 HydrophobicContact CD1-CD2 4.04Å; I93-L102 HydrophobicContact CG2-CB 4.09Å; I93-L102 HydrophobicContact CG2-CD2 4.17Å; I93-L102 PolarHBondContact O-N 2.86Å; I93-F123 HydrophobicContact CD1-CD2 4.08Å; I93-F123 HydrophobicContact CG1-CD2 4.38Å; I93-Y135 HydrophobicContact CD1-CD1 4.21Å; I93-Y135 HydrophobicContact CD1-CG 4.36Å; I93-L144 HydrophobicContact CD1-CD1 4.07Å
94	L	98.5	Very high	96.3	Very high	33 Å²	33	42.4 Å²	42.4	17%	0.173	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	124.9	-178.7	169.6	69.7	0	0	0	110	L81 E82 V96 R100 F101	L81-L94 CarbonylContact C-O 3.58Å; L81-L94 WeakPolarHBondContact CA-O 3.21Å; E82-L94 HydrophobicContact CB-CB 4.16Å; E82-L94 PolarHBondContact N-O 3.46Å; E82-L94 PolarHBondContact O-N 2.82Å; L94-V96 PolarHBondContact O-N 2.04Å; L94-R100 VanDerWaalsContact CD1-C 3.5Å; L94-F101 HydrophobicContact CB-CD1 4.16Å; L94-F101 HydrophobicContact CB-CE1 4.27Å; L94-F101 HydrophobicContact CD1-CD1 4.08Å; L94-F101 HydrophobicContact CD1-CE1 4.04Å; L94-F101 HydrophobicContact CD1-CG 4.37Å; L94-F101 HydrophobicContact CD1-CZ 4.3Å
95	G	98.2	Very high	96.4	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	111.4	168.9	0	0	0	0	0	109.8	A98 S99 R100	G95-A98 PolarHBondContact O-N 2.84Å; G95-S99 WeakPolarHBondContact O-CA 3.33Å; G95-S99 PolarHBondContact O-N 2.85Å; G95-R100 PolarHBondContact N-O 3.44Å; G95-R100 PolarHBondContact O-N 2.82Å
96	V	96.9	Very high	96.4	Very high	54 Å²	54	45.1 Å²	45.1	33%	0.327	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-51.9	-170.4	176.6	0	0	0	0	110.8	L80 E82 L94 S99	L80-V96 HydrophobicContact CD2-CB 4.39Å; L80-V96 HydrophobicContact CD2-CG2 4.4Å; L80-V96 HydrophobicContact CG-CB 4.43Å; L80-V96 HydrophobicContact CG-CG2 4.18Å; L80-V96 PolarHBondContact O-N 3.05Å; E82-V96 HydrophobicContact CB-CG2 3.92Å; L94-V96 PolarHBondContact O-N 2.04Å; V96-S99 PolarHBondContact O-N 3.08Å
97	K	96.9	Very high	96.4	Very high	113 Å²	113	47.2 Å²	47.2	49%	0.491	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-38.4	-178.4	-178.6	61.3	176.4	-177.3	0	112.9	P77 E78	P77-K97 HydrophobicContact CB-CB 4.32Å; P77-K97 HydrophobicContact CB-CD 4.47Å; P77-K97 HydrophobicContact CB-CG 4.15Å; P77-K97 VanDerWaalsContact O-CB 3.27Å; P77-K97 WeakPolarHBondContact O-CB 3.42Å; E78-K97 HydrophobicContact CG-CG 4.18Å
98	A	97.6	Very high	96.3	Very high	14 Å²	14	43.3 Å²	43.3	12%	0.116	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.7	-16.6	-179.6	0	0	0	0	0	113.3	I63 G95 R100	I63-A98 HydrophobicContact CG2-CB 4.27Å; I63-A98 WeakPolarHBondContact O-CB 3.44Å; G95-A98 PolarHBondContact O-N 2.84Å; A98-R100 VanDerWaalsContact C-N 3.26Å; A98-R100 HydrophobicContact CB-CB 4.32Å; A98-R100 HydrophobicContact CB-CG 4.42Å; A98-R100 WeakPolarHBondContact O-CG 3.47Å; A98-R100 PolarHBondContact O-N 3.16Å
99	S	98	Very high	96.5	Very high	83 Å²	83	40.3 Å²	40.3	58%	0.58	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.9	44.8	-171.8	-60.6	0	0	0	0	112.3	G95 V96	G95-S99 WeakPolarHBondContact O-CA 3.33Å; G95-S99 PolarHBondContact O-N 2.85Å; V96-S99 PolarHBondContact O-N 3.08Å
100	R	98.7	Very high	96.7	Very high	56 Å²	56	38.8 Å²	38.8	21%	0.211	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	131.3	-176.7	-73.7	174.4	-178.1	-85	-0.6	111.9	I63 Q65 L94 G95 A98 G112 S113	I63-R100 HydrophobicContact CG2-CB 4.01Å; Q65-R100 PolarHBondContact O-NE 3.22Å; Q65-R100 PolarHBondContact O-NH2 2.78Å; L94-R100 VanDerWaalsContact CD1-C 3.5Å; G95-R100 PolarHBondContact N-O 3.44Å; G95-R100 PolarHBondContact O-N 2.82Å; A98-R100 VanDerWaalsContact C-N 3.26Å; A98-R100 HydrophobicContact CB-CB 4.32Å; A98-R100 HydrophobicContact CB-CG 4.42Å; A98-R100 WeakPolarHBondContact O-CG 3.47Å; A98-R100 PolarHBondContact O-N 3.16Å; R100-G112 PolarHBondContact NH1-O 2.82Å; R100-G112 VanDerWaalsContact NH1-O 3.07Å; R100-S113 CarbonylContact C-O 3.5Å; R100-S113 VanDerWaalsContact CA-O 3.26Å; R100-S113 WeakPolarHBondContact CA-O 3.41Å
101	F	98.8	Very high	96.8	Very high	35 Å²	35	42.3 Å²	42.3	15%	0.154	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	135.4	172.1	-59.1	-78.3	0	0	0	109.9	I93 L94 C103 G112 S113 F116 C121	I93-F101 CarbonylContact O-C 3.57Å; I93-F101 WeakPolarHBondContact O-CA 3.4Å; L94-F101 HydrophobicContact CB-CD1 4.16Å; L94-F101 HydrophobicContact CB-CE1 4.27Å; L94-F101 HydrophobicContact CD1-CD1 4.08Å; L94-F101 HydrophobicContact CD1-CE1 4.04Å; L94-F101 HydrophobicContact CD1-CG 4.37Å; L94-F101 HydrophobicContact CD1-CZ 4.3Å; F101-C103 PolarHBondContact O-N 2.72Å; F101-C103 PolarHBondContact O-SG 2.8Å; F101-G112 CarbonylContact O-C 3.41Å; F101-G112 VanDerWaalsContact O-CA 3.3Å; F101-G112 WeakPolarHBondContact O-CA 3.26Å; F101-S113 PolarHBondContact N-O 3.14Å; F101-S113 PolarHBondContact O-N 2.89Å; F101-F116 HydrophobicContact CD1-CB 4.33Å; F101-F116 AromaticContact CD1-CD2 3.91Å; F101-F116 HydrophobicContact CD1-CD2 3.91Å; F101-F116 HydrophobicContact CD2-CB 3.9Å; F101-F116 HydrophobicContact CE1-CB 4.19Å; F101-F116 HydrophobicContact CE1-CD2 4.22Å; F101-F116 HydrophobicContact CE2-CB 3.74Å; F101-F116 HydrophobicContact CG-CB 4.2Å; F101-F116 HydrophobicContact CG-CD2 4.18Å; F101-F116 HydrophobicContact CZ-CB 3.89Å; F101-C121 HydrophobicContact CB-CB 4.35Å
102	L	98.7	Very high	96.9	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	128.4	165.3	-175.8	60.9	0	0	0	108.2	L61 I63 V69 I93 L110 C121 F123 L144	L61-L102 HydrophobicContact CD1-CD2 3.84Å; L61-L102 HydrophobicContact CD2-CD2 4.38Å; I63-L102 HydrophobicContact CD1-CB 3.87Å; I63-L102 HydrophobicContact CD1-CD1 4.3Å; V69-L102 HydrophobicContact CB-CD1 4.42Å; V69-L102 HydrophobicContact CG1-CD1 3.91Å; V69-L102 HydrophobicContact CG2-CD1 3.7Å; I93-L102 HydrophobicContact CB-CB 3.99Å; I93-L102 HydrophobicContact CB-CD2 4.34Å; I93-L102 HydrophobicContact CD1-CD2 4.04Å; I93-L102 HydrophobicContact CG2-CB 4.09Å; I93-L102 HydrophobicContact CG2-CD2 4.17Å; I93-L102 PolarHBondContact O-N 2.86Å; L102-L110 HydrophobicContact CD1-CB 4.24Å; L102-L110 HydrophobicContact CD1-CD1 4.49Å; L102-C121 WeakPolarHBondContact O-CB 3.48Å; L102-F123 HydrophobicContact CB-CE2 4.45Å; L102-F123 HydrophobicContact CG-CE2 4.38Å; L102-F123 HydrophobicContact CG-CZ 4.34Å; L102-F123 VanDerWaalsContact O-CE2 3.26Å; L102-F123 WeakPolarHBondContact O-CE2 3.22Å; L102-L144 HydrophobicContact CD2-CD1 3.64Å; L102-L144 HydrophobicContact CD2-CD2 4.1Å
103	C	98.4	Very high	97	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136	158.1	179	-50.9	0	0	0	0	109.2	F101 L110 Y111 S113 A120 C121	F101-C103 PolarHBondContact O-N 2.72Å; F101-C103 PolarHBondContact O-SG 2.8Å; C103-L110 WeakPolarHBondContact O-CA 3.4Å; C103-Y111 HydrophobicContact CB-CD1 4.15Å; C103-Y111 HydrophobicContact CB-CD2 4.35Å; C103-Y111 HydrophobicContact CB-CE1 3.61Å; C103-Y111 HydrophobicContact CB-CE2 3.85Å; C103-Y111 HydrophobicContact CB-CG 4.49Å; C103-Y111 VanDerWaalsContact CB-CZ 3.44Å; C103-Y111 PolarHBondContact N-O 3.48Å; C103-Y111 WeakPolarHBondContact O-CD1 3.48Å; C103-Y111 PolarHBondContact O-N 2.82Å; C103-S113 VanDerWaalsContact SG-CB 3.57Å; C103-A120 CarbonylContact C-O 3.43Å; C103-A120 VanDerWaalsContact CA-O 3.28Å; C103-A120 WeakPolarHBondContact CA-O 3.09Å; C103-A120 HydrophobicContact CB-CB 4.1Å; C103-C121 HydrophobicContact CB-CB 4.04Å; C103-C121 WeakPolarHBondContact CB-SG 3.45Å; C103-C121 WeakPolarHBondContact SG-CB 3.49Å; C103-C121 CovalentContact SG-SG 2.04Å; C103-C121 PolarHBondContact SG-SG 2.76Å
104	Q	97.6	Very high	97	Very high	1 Å²	1	45.5 Å²	45.5	1%	0.005	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	130.4	-178.9	-177	168	55.4	0	0	109.8	G108 T109 L110 A120 F123 L142 P143	Q104-G108 PolarHBondContact NE2-O 2.98Å; Q104-T109 WeakPolarHBondContact CA-O 3.17Å; Q104-L110 HydrophobicContact CB-CD2 3.87Å; Q104-L110 HydrophobicContact CG-CD2 3.91Å; Q104-A120 PolarHBondContact N-O 2.86Å; Q104-F123 HydrophobicContact CB-CE1 4.04Å; Q104-F123 HydrophobicContact CB-CZ 4.34Å; Q104-L142 PolarHBondContact OE1-O 3.28Å; Q104-L142 VanDerWaalsContact OE1-O 3.08Å; Q104-P143 PolarHBondContact NE2-O 2.82Å
105	Q	96.3	Very high	96.9	Very high	83 Å²	83	50.8 Å²	50.8	39%	0.388	28%	0.277	S	S	.	.			trans	-74.9	161	171.6	-67.8	-177.4	-76.9	0	0	110.5	D107 G108 T109 Y111	Q105-D107 WeakPolarHBondContact CB-OD1 3.26Å; Q105-D107 PolarHBondContact O-N 3.1Å; Q105-D107 VanDerWaalsContact O-N 3.08Å; Q105-G108 WeakPolarHBondContact O-CA 3.35Å; Q105-G108 PolarHBondContact O-N 3.47Å; Q105-T109 PolarHBondContact N-O 2.86Å; Q105-Y111 HydrophobicContact CG-CD1 3.67Å; Q105-Y111 HydrophobicContact CG-CE1 3.55Å
106	P	95	Very high	97	Very high	98 Å²	98	54.3 Å²	54.3	64%	0.636	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	-22.3	-179.2	-26.4	35.3	0	0	0	115.1	G108 L142	P106-G108 VanDerWaalsContact C-N 3.28Å; P106-L142 WeakPolarHBondContact O-CD1 3.5Å
107	D	91.9	Very high	97	Very high	113 Å²	113	54.8 Å²	54.8	60%	0.604	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.3	-5.2	175.6	66.7	-14	0	0	0	113.1	Q105 T109	Q105-D107 WeakPolarHBondContact CB-OD1 3.26Å; Q105-D107 PolarHBondContact O-N 3.1Å; Q105-D107 VanDerWaalsContact O-N 3.08Å; D107-T109 VanDerWaalsContact CG-OG1 3.25Å; D107-T109 VanDerWaalsContact OD1-CB 3.27Å; D107-T109 WeakPolarHBondContact OD1-CB 3.19Å; D107-T109 PolarHBondContact OD1-N 3.47Å; D107-T109 PolarHBondContact OD1-OG1 2.89Å; D107-T109 PolarHBondContact OD2-OG1 2.76Å
108	G	91.9	Very high	97	Very high	18 Å²	18	53 Å²	53	19%	0.186	29%	0.293	C	S	.	.	S	Bend	trans	96.3	-5.6	-177.6	0	0	0	0	0	114.6	Q104 Q105 P106	Q104-G108 PolarHBondContact NE2-O 2.98Å; Q105-G108 WeakPolarHBondContact O-CA 3.35Å; Q105-G108 PolarHBondContact O-N 3.47Å; P106-G108 VanDerWaalsContact C-N 3.28Å
109	T	93.7	Very high	97	Very high	68 Å²	68	58.3 Å²	58.3	42%	0.417	32%	0.315	S	S	.	.			trans	-68.1	131.4	-177.4	-59.8	0	0	0	0	111.1	Q104 Q105 D107	Q104-T109 WeakPolarHBondContact CA-O 3.17Å; Q105-T109 PolarHBondContact N-O 2.86Å; D107-T109 VanDerWaalsContact CG-OG1 3.25Å; D107-T109 VanDerWaalsContact OD1-CB 3.27Å; D107-T109 WeakPolarHBondContact OD1-CB 3.19Å; D107-T109 PolarHBondContact OD1-N 3.47Å; D107-T109 PolarHBondContact OD1-OG1 2.89Å; D107-T109 PolarHBondContact OD2-OG1 2.76Å
110	L	96.1	Very high	97	Very high	18 Å²	18	54.8 Å²	54.8	9%	0.094	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	141	-178.3	-56.5	-174.9	0	0	0	111.8	V69 L102 C103 Q104 L144 R145	V69-L110 HydrophobicContact CB-CB 4.02Å; V69-L110 HydrophobicContact CG1-CB 3.98Å; V69-L110 HydrophobicContact CG1-CD1 4.24Å; V69-L110 HydrophobicContact CG2-CB 4.32Å; L102-L110 HydrophobicContact CD1-CB 4.24Å; L102-L110 HydrophobicContact CD1-CD1 4.49Å; C103-L110 WeakPolarHBondContact O-CA 3.4Å; Q104-L110 HydrophobicContact CB-CD2 3.87Å; Q104-L110 HydrophobicContact CG-CD2 3.91Å; L110-L144 HydrophobicContact CD1-CB 4.46Å; L110-L144 HydrophobicContact CD1-CD2 3.96Å; L110-L144 HydrophobicContact CD2-CD2 3.36Å; L110-L144 HydrophobicContact CG-CD2 4.31Å; L110-R145 WeakPolarHBondContact CD1-O 3.36Å
111	Y	97.9	Very high	97	Very high	74 Å²	74	52.1 Å²	52.1	29%	0.29	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.6	160.9	176.9	69.7	-78	0	0	0	111.7	C103 Q105	C103-Y111 HydrophobicContact CB-CD1 4.15Å; C103-Y111 HydrophobicContact CB-CD2 4.35Å; C103-Y111 HydrophobicContact CB-CE1 3.61Å; C103-Y111 HydrophobicContact CB-CE2 3.85Å; C103-Y111 HydrophobicContact CB-CG 4.49Å; C103-Y111 VanDerWaalsContact CB-CZ 3.44Å; C103-Y111 PolarHBondContact N-O 3.48Å; C103-Y111 WeakPolarHBondContact O-CD1 3.48Å; C103-Y111 PolarHBondContact O-N 2.82Å; Q105-Y111 HydrophobicContact CG-CD1 3.67Å; Q105-Y111 HydrophobicContact CG-CE1 3.55Å
112	G	98.4	Very high	97	Very high	5 Å²	5	50.6 Å²	50.6	5%	0.052	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	110.8	178.3	0	0	0	0	0	112.4	G67 R100 F101	G67-G112 WeakPolarHBondContact CA-O 3.46Å; G67-G112 PolarHBondContact O-N 3.07Å; R100-G112 PolarHBondContact NH1-O 2.82Å; R100-G112 VanDerWaalsContact NH1-O 3.07Å; F101-G112 CarbonylContact O-C 3.41Å; F101-G112 VanDerWaalsContact O-CA 3.3Å; F101-G112 WeakPolarHBondContact O-CA 3.26Å
113	S	98.5	Very high	96.9	Very high	21 Å²	21	50.6 Å²	50.6	15%	0.147	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	137.5	177.8	-177.7	0	0	0	0	112.1	R100 F101 C103 H115	R100-S113 CarbonylContact C-O 3.5Å; R100-S113 VanDerWaalsContact CA-O 3.26Å; R100-S113 WeakPolarHBondContact CA-O 3.41Å; F101-S113 PolarHBondContact N-O 3.14Å; F101-S113 PolarHBondContact O-N 2.89Å; C103-S113 VanDerWaalsContact SG-CB 3.57Å; S113-H115 WeakPolarHBondContact CB-O 3.3Å; S113-H115 PolarHBondContact O-N 2.68Å; S113-H115 PolarHBondContact OG-N 3.41Å; S113-H115 PolarHBondContact OG-O 2.82Å
114	P	98.2	Very high	96.9	Very high	69 Å²	69	55.3 Å²	55.3	45%	0.448	29%	0.292	S	S	.	.	S	Bend	trans	-72.7	-17.8	171.8	29.9	-30.3	0	0	0	112.5
115	H	98.3	Very high	96.8	Very high	143 Å²	143	57 Å²	57	66%	0.662	30%	0.301	S	S	*	.	S	Bend	trans	-113.9	138.5	179.3	-56.3	100.3	0	0	0	110.3	S113	S113-H115 WeakPolarHBondContact CB-O 3.3Å; S113-H115 PolarHBondContact O-N 2.68Å; S113-H115 PolarHBondContact OG-N 3.41Å; S113-H115 PolarHBondContact OG-O 2.82Å
116	F	98.3	Very high	96.7	Very high	74 Å²	74	56.8 Å²	56.8	33%	0.325	30%	0.302	S	S	.	.			trans	-76.4	125.9	176.4	179.2	-102	0	0	0	110.5	L86 Q92 F101 P118 C121	L86-F116 HydrophobicContact CD1-CE2 4.16Å; L86-F116 HydrophobicContact CD1-CZ 3.63Å; L86-F116 HydrophobicContact CD2-CZ 4.02Å; L86-F116 HydrophobicContact CG-CZ 4.49Å; Q92-F116 HydrophobicContact CB-CD2 4.32Å; Q92-F116 HydrophobicContact CB-CE2 3.77Å; F101-F116 HydrophobicContact CD1-CB 4.33Å; F101-F116 AromaticContact CD1-CD2 3.91Å; F101-F116 HydrophobicContact CD1-CD2 3.91Å; F101-F116 HydrophobicContact CD2-CB 3.9Å; F101-F116 HydrophobicContact CE1-CB 4.19Å; F101-F116 HydrophobicContact CE1-CD2 4.22Å; F101-F116 HydrophobicContact CE2-CB 3.74Å; F101-F116 HydrophobicContact CG-CB 4.2Å; F101-F116 HydrophobicContact CG-CD2 4.18Å; F101-F116 HydrophobicContact CZ-CB 3.89Å; F116-P118 HydrophobicContact CE1-CB 4.01Å; F116-P118 HydrophobicContact CZ-CB 4.35Å; F116-C121 HydrophobicContact CD2-CB 3.89Å; F116-C121 HydrophobicContact CE2-CB 3.84Å
117	D	98.1	Very high	96.6	Very high	65 Å²	65	58.3 Å²	58.3	35%	0.348	30%	0.303	S	S	.	.			trans	-117.6	117.4	171.1	178.1	-7.1	0	0	0	108.5	E119 A120 C121	D117-E119 PolarHBondContact O-N 2.72Å; D117-E119 PolarHBondContact OD1-N 2.75Å; D117-A120 HydrophobicContact CB-CB 4.32Å; D117-A120 PolarHBondContact O-N 3.41Å; D117-C121 PolarHBondContact N-SG 3.44Å; D117-C121 WeakPolarHBondContact O-CA 3.47Å; D117-C121 WeakPolarHBondContact O-CB 3.45Å; D117-C121 PolarHBondContact O-N 3.39Å; D117-C121 PolarHBondContact O-SG 2.85Å
118	P	96.9	Very high	96.5	Very high	75 Å²	75	56.1 Å²	56.1	49%	0.487	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-25.3	-178.2	26.8	-34.9	0	0	0	113.5	F116 S122	F116-P118 HydrophobicContact CE1-CB 4.01Å; F116-P118 HydrophobicContact CZ-CB 4.35Å; P118-S122 WeakPolarHBondContact CA-OG 3.5Å; P118-S122 WeakPolarHBondContact O-CB 3.43Å; P118-S122 PolarHBondContact O-OG 3.02Å
119	E	97.2	Very high	96.5	Very high	126 Å²	126	65.2 Å²	65.2	59%	0.589	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.8	-42.6	-179.9	-63.1	-171.2	175.8	0	0	111.6	D117 V139	D117-E119 PolarHBondContact O-N 2.72Å; D117-E119 PolarHBondContact OD1-N 2.75Å; E119-V139 HydrophobicContact CB-CG2 4.07Å; E119-V139 HydrophobicContact CG-CG2 4.33Å
120	A	98.1	Very high	96.2	Very high	8 Å²	8	66.2 Å²	66.2	7%	0.066	33%	0.332	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.1	-27.5	-176.3	0	0	0	0	0	114.2	C103 Q104 D117	C103-A120 CarbonylContact C-O 3.43Å; C103-A120 VanDerWaalsContact CA-O 3.28Å; C103-A120 WeakPolarHBondContact CA-O 3.09Å; C103-A120 HydrophobicContact CB-CB 4.1Å; Q104-A120 PolarHBondContact N-O 2.86Å; D117-A120 HydrophobicContact CB-CB 4.32Å; D117-A120 PolarHBondContact O-N 3.41Å
121	C	98.5	Very high	95.9	Very high	1 Å²	1	67.2 Å²	67.2	1%	0.007	35%	0.347	C	S	.	.	S	Bend	trans	-114.2	12.7	-166.5	-39.7	0	0	0	0	114.1	F101 L102 C103 F116 D117	F101-C121 HydrophobicContact CB-CB 4.35Å; L102-C121 WeakPolarHBondContact O-CB 3.48Å; C103-C121 HydrophobicContact CB-CB 4.04Å; C103-C121 WeakPolarHBondContact CB-SG 3.45Å; C103-C121 WeakPolarHBondContact SG-CB 3.49Å; C103-C121 CovalentContact SG-SG 2.04Å; C103-C121 PolarHBondContact SG-SG 2.76Å; F116-C121 HydrophobicContact CD2-CB 3.89Å; F116-C121 HydrophobicContact CE2-CB 3.84Å; D117-C121 PolarHBondContact N-SG 3.44Å; D117-C121 WeakPolarHBondContact O-CA 3.47Å; D117-C121 WeakPolarHBondContact O-CB 3.45Å; D117-C121 PolarHBondContact O-N 3.39Å; D117-C121 PolarHBondContact O-SG 2.85Å
122	S	98.3	Very high	95.6	Very high	3 Å²	3	65.6 Å²	65.6	2%	0.021	34%	0.341	C	S	.	.			trans	-105.5	129.1	175.9	-54.7	0	0	0	0	111.2	L86 P118 E138	L86-S122 WeakPolarHBondContact CD1-OG 3.26Å; P118-S122 WeakPolarHBondContact CA-OG 3.5Å; P118-S122 WeakPolarHBondContact O-CB 3.43Å; P118-S122 PolarHBondContact O-OG 3.02Å; S122-E138 PolarHBondContact O-N 3.37Å
123	F	98.2	Very high	95.5	Very high	0 Å²	0	66 Å²	66	0%	0	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	133.4	-176.8	-54.6	-82.9	0	0	0	112.2	V90 I91 I93 L102 Q104 Q136 L144	V90-F123 CarbonylContact C-O 3.57Å; V90-F123 VanDerWaalsContact CA-O 3.3Å; V90-F123 WeakPolarHBondContact CA-O 3.28Å; I91-F123 HydrophobicContact CG1-CB 4.46Å; I91-F123 PolarHBondContact N-O 2.73Å; I91-F123 PolarHBondContact O-N 3.26Å; I93-F123 HydrophobicContact CD1-CD2 4.08Å; I93-F123 HydrophobicContact CG1-CD2 4.38Å; L102-F123 HydrophobicContact CB-CE2 4.45Å; L102-F123 HydrophobicContact CG-CE2 4.38Å; L102-F123 HydrophobicContact CG-CZ 4.34Å; L102-F123 VanDerWaalsContact O-CE2 3.26Å; L102-F123 WeakPolarHBondContact O-CE2 3.22Å; Q104-F123 HydrophobicContact CB-CE1 4.04Å; Q104-F123 HydrophobicContact CB-CZ 4.34Å; F123-Q136 CarbonylContact C-O 3.5Å; F123-Q136 VanDerWaalsContact CA-O 3.23Å; F123-Q136 WeakPolarHBondContact CA-O 3.15Å; F123-L144 HydrophobicContact CD1-CD2 3.86Å; F123-L144 HydrophobicContact CD1-CG 4.16Å; F123-L144 HydrophobicContact CE1-CD2 3.4Å; F123-L144 VanDerWaalsContact CE1-CD2 3.4Å; F123-L144 HydrophobicContact CE1-CG 4.2Å; F123-L144 HydrophobicContact CZ-CD2 3.92Å
124	R	97.3	Very high	95.3	Very high	98 Å²	98	66.1 Å²	66.1	37%	0.37	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72	122.6	165.6	-62	-177.1	-176.1	-68.2	-10.7	108.9	G89 V90 Y135 Q136 E138	G89-R124 CarbonylContact O-C 3.56Å; G89-R124 VanDerWaalsContact O-CA 3.29Å; G89-R124 WeakPolarHBondContact O-CA 3.13Å; V90-R124 HydrophobicContact CG2-CG 4.14Å; R124-Y135 CarbonylContact O-C 3.54Å; R124-Y135 VanDerWaalsContact O-CA 3.3Å; R124-Y135 WeakPolarHBondContact O-CA 3.34Å; R124-Q136 HydrophobicContact CB-CB 4.43Å; R124-Q136 PolarHBondContact N-O 2.8Å; R124-Q136 PolarHBondContact O-N 2.85Å; R124-E138 IonicContact CZ-OE1 2.89Å; R124-E138 IonicContact NH1-OE1 2.97Å; R124-E138 IonicContact NH2-OE1 3.79Å; R124-E138 PolarHBondContact NH2-OE1 2.67Å
125	E	95.4	Very high	95.3	Very high	38 Å²	38	62.8 Å²	62.8	18%	0.178	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	115.7	174.2	179.5	177.5	-158.9	0	0	108.9	R45 G89 I91 N133 Y135	R45-E125 IonicContact CZ-OE1 2.85Å; R45-E125 IonicContact CZ-OE2 3.48Å; R45-E125 IonicContact NH1-OE1 2.79Å; R45-E125 PolarHBondContact NH1-OE1 2.83Å; R45-E125 IonicContact NH1-OE2 3.28Å; R45-E125 PolarHBondContact NH1-OE2 3.02Å; R45-E125 IonicContact NH2-OE1 3.67Å; R45-E125 PolarHBondContact NH2-OE1 2.95Å; R45-E125 IonicContact NH2-OE2 3.54Å; R45-E125 PolarHBondContact NH2-OE2 3.48Å; G89-E125 PolarHBondContact O-N 3.49Å; I91-E125 HydrophobicContact CD1-CB 4.45Å; I91-E125 HydrophobicContact CG2-CB 4.45Å; E125-N133 HydrophobicContact CG-CB 4.46Å; E125-N133 PolarHBondContact OE1-ND2 2.88Å; E125-Y135 HydrophobicContact CB-CD1 4.02Å; E125-Y135 HydrophobicContact CB-CE1 3.88Å; E125-Y135 HydrophobicContact CG-CD1 4.14Å; E125-Y135 HydrophobicContact CG-CE1 3.55Å
126	L	94.2	Very high	95.2	Very high	78 Å²	78	58.8 Å²	58.8	41%	0.408	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	118.9	-175.7	-58.3	174.5	0	0	0	109.4	N133 V134	L126-N133 CarbonylContact O-C 3.52Å; L126-N133 VanDerWaalsContact O-CA 3.26Å; L126-N133 WeakPolarHBondContact O-CA 3.34Å; L126-V134 PolarHBondContact N-O 2.85Å; L126-V134 PolarHBondContact O-N 3.22Å
127	L	92.6	Very high	95.1	Very high	129 Å²	129	55.3 Å²	55.3	68%	0.675	29%	0.286	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.8	127.5	173.9	-178.2	66	0	0	0	109.7	N133	L127-N133 VanDerWaalsContact CD1-OD1 3.22Å; L127-N133 WeakPolarHBondContact CD1-OD1 3.4Å
128	L	91	Very high	95.1	Very high	67 Å²	67	54.3 Å²	54.3	35%	0.351	28%	0.28	S	S	.	.			trans	-87.4	164.8	173.7	-61.9	-176	0	0	0	111.3	D130 G131 Y132 V134 R163	L128-D130 WeakPolarHBondContact CB-OD1 3.46Å; L128-D130 PolarHBondContact O-N 3.47Å; L128-G131 PolarHBondContact O-N 2.98Å; L128-G131 VanDerWaalsContact O-N 3.1Å; L128-Y132 WeakPolarHBondContact CB-O 3.27Å; L128-Y132 PolarHBondContact N-O 2.88Å; L128-V134 HydrophobicContact CD1-CG2 3.71Å; L128-V134 HydrophobicContact CD2-CG2 3.96Å; L128-V134 HydrophobicContact CG-CG2 3.92Å; L128-R163 HydrophobicContact CD1-CB 3.91Å
129	E	90.5	Very high	95	Very high	209 Å²	209	54.5 Å²	54.5	98%	0.977	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.5	-25.8	178.3	-62	-175.5	166.7	0	0	113.3	G131	E129-G131 VanDerWaalsContact C-N 3.26Å; E129-G131 PolarHBondContact O-N 3.18Å
130	D	87.9	Confident	94.8	Very high	89 Å²	89	52 Å²	52	48%	0.476	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81	-2.6	177.2	65.8	2.9	0	0	0	113.5	L128 Y132 R163	L128-D130 WeakPolarHBondContact CB-OD1 3.46Å; L128-D130 PolarHBondContact O-N 3.47Å; D130-Y132 WeakPolarHBondContact OD1-CB 3.36Å; D130-Y132 PolarHBondContact OD1-N 3.01Å; D130-R163 WeakPolarHBondContact OD2-CD 3.48Å; D130-R163 IonicContact OD2-NE 3Å
131	G	89.6	Confident	94.6	Very high	40 Å²	40	53 Å²	53	41%	0.412	28%	0.279	S	S	.	.	S	Bend	trans	86.9	-0.4	-180	0	0	0	0	0	115	L128 E129	L128-G131 PolarHBondContact O-N 2.98Å; L128-G131 VanDerWaalsContact O-N 3.1Å; E129-G131 VanDerWaalsContact C-N 3.26Å; E129-G131 PolarHBondContact O-N 3.18Å
132	Y	92.9	Very high	94.4	Very high	40 Å²	40	55.7 Å²	55.7	16%	0.157	29%	0.293	C	S	.	.	P	Polyproline II helix	trans	-84.9	160.2	171.2	-71.9	-116.5	0	0	0	110.6	D52 L128 D130 R163 L165	D52-Y132 PolarHBondContact OD2-OH 3.08Å; L128-Y132 WeakPolarHBondContact CB-O 3.27Å; L128-Y132 PolarHBondContact N-O 2.88Å; D130-Y132 WeakPolarHBondContact OD1-CB 3.36Å; D130-Y132 PolarHBondContact OD1-N 3.01Å; Y132-R163 HydrophobicContact CD1-CB 4.26Å; Y132-R163 HydrophobicContact CD1-CG 3.76Å; Y132-R163 HydrophobicContact CE1-CG 4.46Å; Y132-R163 HydrophobicContact CG-CB 4.3Å; Y132-R163 HydrophobicContact CG-CG 4.02Å; Y132-L165 HydrophobicContact CD1-CB 3.92Å; Y132-L165 HydrophobicContact CE1-CB 3.84Å
133	N	94.9	Very high	94.2	Very high	14 Å²	14	56.5 Å²	56.5	8%	0.075	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	141.6	174	-69.8	-12.5	0	0	0	111.5	E125 L126 L127 Y135 R163 F164	E125-N133 HydrophobicContact CG-CB 4.46Å; E125-N133 PolarHBondContact OE1-ND2 2.88Å; L126-N133 CarbonylContact O-C 3.52Å; L126-N133 VanDerWaalsContact O-CA 3.26Å; L126-N133 WeakPolarHBondContact O-CA 3.34Å; L127-N133 VanDerWaalsContact CD1-OD1 3.22Å; L127-N133 WeakPolarHBondContact CD1-OD1 3.4Å; N133-Y135 HydrophobicContact CB-CE2 3.96Å; N133-Y135 PolarHBondContact ND2-OH 2.88Å; N133-R163 CarbonylContact O-C 3.57Å; N133-R163 WeakPolarHBondContact O-CA 3.47Å; N133-F164 PolarHBondContact N-O 3.08Å; N133-F164 PolarHBondContact O-N 3.1Å
134	V	95.1	Very high	94	Very high	22 Å²	22	56.5 Å²	56.5	13%	0.133	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	134.7	161.5	173.8	0	0	0	0	108.2	L126 L128 P143 V162 R163	L126-V134 PolarHBondContact N-O 2.85Å; L126-V134 PolarHBondContact O-N 3.22Å; L128-V134 HydrophobicContact CD1-CG2 3.71Å; L128-V134 HydrophobicContact CD2-CG2 3.96Å; L128-V134 HydrophobicContact CG-CG2 3.92Å; V134-P143 HydrophobicContact CG1-CB 3.94Å; V134-V162 HydrophobicContact CG1-CG1 4.25Å; V134-R163 HydrophobicContact CG2-CB 4.41Å
135	Y	97.1	Very high	93.6	Very high	0 Å²	0	55 Å²	55	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	120.8	173.3	-60.4	-81.2	0	0	0	108.4	L49 L83 I91 I93 R124 E125 N133 P143 L144 F164	L49-Y135 HydrophobicContact CD1-CD2 4.34Å; L49-Y135 HydrophobicContact CD1-CE2 3.93Å; L49-Y135 HydrophobicContact CD2-CE2 3.68Å; L49-Y135 WeakPolarHBondContact CD2-OH 3.48Å; L49-Y135 HydrophobicContact CG-CE2 4.45Å; L83-Y135 HydrophobicContact CD2-CE1 4.3Å; I91-Y135 HydrophobicContact CD1-CD1 3.72Å; I91-Y135 HydrophobicContact CD1-CE1 3.45Å; I91-Y135 VanDerWaalsContact CD1-CE1 3.45Å; I91-Y135 HydrophobicContact CG1-CD1 4.37Å; I91-Y135 HydrophobicContact CG1-CE1 4.49Å; I93-Y135 HydrophobicContact CD1-CD1 4.21Å; I93-Y135 HydrophobicContact CD1-CG 4.36Å; R124-Y135 CarbonylContact O-C 3.54Å; R124-Y135 VanDerWaalsContact O-CA 3.3Å; R124-Y135 WeakPolarHBondContact O-CA 3.34Å; E125-Y135 HydrophobicContact CB-CD1 4.02Å; E125-Y135 HydrophobicContact CB-CE1 3.88Å; E125-Y135 HydrophobicContact CG-CD1 4.14Å; E125-Y135 HydrophobicContact CG-CE1 3.55Å; N133-Y135 HydrophobicContact CB-CE2 3.96Å; N133-Y135 PolarHBondContact ND2-OH 2.88Å; Y135-P143 CarbonylContact O-C 3.54Å; Y135-P143 WeakPolarHBondContact O-CA 3.27Å; Y135-L144 VanDerWaalsContact CB-CD1 3.49Å; Y135-L144 HydrophobicContact CD2-CD1 4.21Å; Y135-L144 HydrophobicContact CG-CD1 4.08Å; Y135-L144 PolarHBondContact O-N 2.84Å; Y135-F164 HydrophobicContact CD2-CB 4.39Å; Y135-F164 AromaticContact CD2-CD2 3.99Å; Y135-F164 HydrophobicContact CD2-CD2 3.99Å; Y135-F164 HydrophobicContact CD2-CG 4.43Å; Y135-F164 HydrophobicContact CE2-CB 3.95Å; Y135-F164 HydrophobicContact CE2-CD2 4.4Å; Y135-F164 HydrophobicContact CE2-CG 4.42Å
136	Q	96.5	Very high	93.2	Very high	59 Å²	59	53.8 Å²	53.8	28%	0.276	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	129.1	-174.7	-171.4	-176.2	17.1	0	0	110.2	F123 R124 E138 G141 L142	F123-Q136 CarbonylContact C-O 3.5Å; F123-Q136 VanDerWaalsContact CA-O 3.23Å; F123-Q136 WeakPolarHBondContact CA-O 3.15Å; R124-Q136 HydrophobicContact CB-CB 4.43Å; R124-Q136 PolarHBondContact N-O 2.8Å; R124-Q136 PolarHBondContact O-N 2.85Å; Q136-E138 PolarHBondContact O-N 3.04Å; Q136-G141 VanDerWaalsContact CG-C 3.45Å; Q136-G141 WeakPolarHBondContact CG-O 3.44Å; Q136-G141 VanDerWaalsContact NE2-C 3.34Å; Q136-G141 PolarHBondContact NE2-O 3.25Å; Q136-L142 CarbonylContact C-O 3.42Å; Q136-L142 WeakPolarHBondContact CA-O 3.15Å
137	S	97.3	Very high	92.2	Very high	1 Å²	1	54 Å²	54	1%	0.007	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-51	128.9	174.3	164.2	0	0	0	0	109.5	V139 H140 G141 L142	S137-V139 VanDerWaalsContact C-N 3.28Å; S137-V139 PolarHBondContact O-N 3.17Å; S137-V139 PolarHBondContact OG-N 2.81Å; S137-H140 PolarHBondContact OG-N 2.8Å; S137-H140 VanDerWaalsContact OG-N 3.08Å; S137-G141 WeakPolarHBondContact O-CA 3.32Å; S137-G141 PolarHBondContact O-N 3Å; S137-L142 PolarHBondContact N-O 3.25Å
138	E	96.9	Very high	90.9	Very high	44 Å²	44	52 Å²	52	21%	0.206	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-38.9	-178.3	172.3	158	-141.6	0	0	111.6	K87 V90 S122 R124 Q136	K87-E138 WeakPolarHBondContact CE-OE1 3.33Å; K87-E138 VanDerWaalsContact CE-OE2 3.28Å; K87-E138 WeakPolarHBondContact CE-OE2 3.43Å; K87-E138 IonicContact NZ-OE1 3.83Å; K87-E138 PolarHBondContact NZ-OE1 2.75Å; K87-E138 IonicContact NZ-OE2 3.57Å; K87-E138 PolarHBondContact NZ-OE2 3.41Å; V90-E138 WeakPolarHBondContact CG1-OE2 3.34Å; S122-E138 PolarHBondContact O-N 3.37Å; R124-E138 IonicContact CZ-OE1 2.89Å; R124-E138 IonicContact NH1-OE1 2.97Å; R124-E138 IonicContact NH2-OE1 3.79Å; R124-E138 PolarHBondContact NH2-OE1 2.67Å; Q136-E138 PolarHBondContact O-N 3.04Å
139	V	96.4	Very high	89.3	Confident	79 Å²	79	58.1 Å²	58.1	48%	0.479	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.5	-46.4	-176.5	177	0	0	0	0	111.7	E119 S137	E119-V139 HydrophobicContact CB-CG2 4.07Å; E119-V139 HydrophobicContact CG-CG2 4.33Å; S137-V139 VanDerWaalsContact C-N 3.28Å; S137-V139 PolarHBondContact O-N 3.17Å; S137-V139 PolarHBondContact OG-N 2.81Å
140	H	93.1	Very high	87.4	Confident	72 Å²	72	54.9 Å²	54.9	33%	0.333	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90	-17.8	-172.3	-58.9	-52.6	0	0	0	113.6	S137 L142	S137-H140 PolarHBondContact OG-N 2.8Å; S137-H140 VanDerWaalsContact OG-N 3.08Å; H140-L142 HydrophobicContact CB-CD1 4.48Å; H140-L142 HydrophobicContact CB-CG 4.26Å; H140-L142 PolarHBondContact O-N 2.98Å; H140-L142 VanDerWaalsContact O-N 3.14Å
141	G	93.9	Very high	85.4	Confident	31 Å²	31	53.7 Å²	53.7	32%	0.32	29%	0.287	S	S	.	.			trans	65.7	13	-176.6	0	0	0	0	0	113.4	Q136 S137	Q136-G141 VanDerWaalsContact CG-C 3.45Å; Q136-G141 WeakPolarHBondContact CG-O 3.44Å; Q136-G141 VanDerWaalsContact NE2-C 3.34Å; Q136-G141 PolarHBondContact NE2-O 3.25Å; S137-G141 WeakPolarHBondContact O-CA 3.32Å; S137-G141 PolarHBondContact O-N 3Å
142	L	93.9	Very high	83.3	Confident	56 Å²	56	58.1 Å²	58.1	29%	0.293	31%	0.308	S	S	.	.	P	Polyproline II helix	trans	-88.6	137.8	175	-63.2	179.1	0	0	0	109.4	Q104 P106 Q136 S137 H140	Q104-L142 PolarHBondContact OE1-O 3.28Å; Q104-L142 VanDerWaalsContact OE1-O 3.08Å; P106-L142 WeakPolarHBondContact O-CD1 3.5Å; Q136-L142 CarbonylContact C-O 3.42Å; Q136-L142 WeakPolarHBondContact CA-O 3.15Å; S137-L142 PolarHBondContact N-O 3.25Å; H140-L142 HydrophobicContact CB-CD1 4.48Å; H140-L142 HydrophobicContact CB-CG 4.26Å; H140-L142 PolarHBondContact O-N 2.98Å; H140-L142 VanDerWaalsContact O-N 3.14Å
143	P	94.3	Very high	81.1	Confident	21 Å²	21	64 Å²	64	14%	0.136	34%	0.342	C	S	.	.	B	Isolated β-bridge	trans	-79.2	156.4	176.8	35.5	-36.7	0	0	0	111.4	Q104 V134 Y135 R145 V162	Q104-P143 PolarHBondContact NE2-O 2.82Å; V134-P143 HydrophobicContact CG1-CB 3.94Å; Y135-P143 CarbonylContact O-C 3.54Å; Y135-P143 WeakPolarHBondContact O-CA 3.27Å; P143-R145 PolarHBondContact O-N 2.96Å; P143-V162 HydrophobicContact CB-CG1 3.25Å; P143-V162 HydrophobicContact CG-CG1 3.45Å; P143-V162 VanDerWaalsContact CG-CG1 3.45Å
144	L	93.2	Very high	78.7	Confident	0 Å²	0	68.9 Å²	68.9	0%	0	37%	0.365	C	S	.	.	P	Polyproline II helix	trans	-60.6	128.7	168.8	-69.3	-171.1	0	0	0	109.3	I93 L102 L110 F123 Y135 F164	I93-L144 HydrophobicContact CD1-CD1 4.07Å; L102-L144 HydrophobicContact CD2-CD1 3.64Å; L102-L144 HydrophobicContact CD2-CD2 4.1Å; L110-L144 HydrophobicContact CD1-CB 4.46Å; L110-L144 HydrophobicContact CD1-CD2 3.96Å; L110-L144 HydrophobicContact CD2-CD2 3.36Å; L110-L144 HydrophobicContact CG-CD2 4.31Å; F123-L144 HydrophobicContact CD1-CD2 3.86Å; F123-L144 HydrophobicContact CD1-CG 4.16Å; F123-L144 HydrophobicContact CE1-CD2 3.4Å; F123-L144 VanDerWaalsContact CE1-CD2 3.4Å; F123-L144 HydrophobicContact CE1-CG 4.2Å; F123-L144 HydrophobicContact CZ-CD2 3.92Å; Y135-L144 VanDerWaalsContact CB-CD1 3.49Å; Y135-L144 HydrophobicContact CD2-CD1 4.21Å; Y135-L144 HydrophobicContact CG-CD1 4.08Å; Y135-L144 PolarHBondContact O-N 2.84Å; L144-F164 HydrophobicContact CB-CE2 3.87Å; L144-F164 HydrophobicContact CB-CZ 4.3Å
145	R	89.1	Confident	76.1	Confident	65 Å²	65	71.1 Å²	71.1	25%	0.245	39%	0.386	C	S	.	.			trans	-134.4	126	174.3	-70.2	-173.3	170	113.9	0.7	108.5	L110 P143 W159 V162	L110-R145 WeakPolarHBondContact CD1-O 3.36Å; P143-R145 PolarHBondContact O-N 2.96Å; R145-W159 VanDerWaalsContact NH2-CG 3.3Å; R145-V162 HydrophobicContact CG-CG2 4.2Å
146	L	85.9	Confident	73.7	Confident	14 Å²	14	77.3 Å²	77.3	7%	0.073	43%	0.425	C	S	.	.	P	Polyproline II helix	trans	-73	141.8	171.3	-67.4	179.7	0	0	0	109.4	T51 V59 L61 V69 Q148 F164	T51-L146 HydrophobicContact CG2-CD1 3.77Å; V59-L146 HydrophobicContact CG2-CD1 3.73Å; L61-L146 HydrophobicContact CB-CD2 4.14Å; L61-L146 HydrophobicContact CD1-CD2 3.85Å; L61-L146 HydrophobicContact CG-CD2 3.79Å; V69-L146 HydrophobicContact CG1-CD2 4.42Å; L146-Q148 PolarHBondContact O-N 3.36Å; L146-F164 HydrophobicContact CD1-CE1 4.04Å; L146-F164 HydrophobicContact CG-CE1 4.06Å; L146-F164 HydrophobicContact CG-CZ 4.15Å
147	P	73.8	Confident	71.2	Confident	81 Å²	81	78.5 Å²	78.5	53%	0.526	45%	0.446	S	S	.	.	P	Polyproline II helix	trans	-60.7	129.5	173.1	22.6	-29.8	0	0	0	110
148	Q	65.4	Low	68.7	Low	87 Å²	87	80.3 Å²	80.3	41%	0.407	46%	0.458	S	S	.	.	P	Polyproline II helix	trans	-68.9	134.9	173.2	-79.6	-173.6	-48.9	0	0	109.7	L146 D150	L146-Q148 PolarHBondContact O-N 3.36Å; Q148-D150 VanDerWaalsContact C-N 3.33Å; Q148-D150 PolarHBondContact O-N 3.2Å
149	R	57.4	Low	66.6	Low	196 Å²	196	86.8 Å²	86.8	74%	0.74	48%	0.481	S	S	*	.	S	Bend	trans	-66	-32.4	-169.3	-153.1	172.4	-171.3	125.2	-3.2	113.2
150	D	50.6	Low	64.7	Low	142 Å²	142	83.5 Å²	83.5	76%	0.759	46%	0.463	S	S	*	.	S	Bend	trans	-161.1	109.5	175.9	-71.4	-63.3	0	0	0	110.5	Q148	Q148-D150 VanDerWaalsContact C-N 3.33Å; Q148-D150 PolarHBondContact O-N 3.2Å
151	S	46.9	Very low	63.4	Low	64 Å²	64	81 Å²	81	45%	0.448	45%	0.453	S	S	.	.			trans	-157.1	79	160.8	-139	0	0	0	0	111.1	N153	S151-N153 PolarHBondContact O-N 3.22Å
152	P	45.7	Very low	62.8	Low	132 Å²	132	81 Å²	81	86%	0.857	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70	2.8	-174.4	24.9	-32	0	0	0	115.1
153	N	45.7	Very low	62.7	Low	163 Å²	163	81.4 Å²	81.4	87%	0.872	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	-141.4	20.8	-167.1	-131.7	11.8	0	0	0	115.7	S151	S151-N153 PolarHBondContact O-N 3.22Å
154	Q	43.6	Very low	62.7	Low	118 Å²	118	80.4 Å²	80.4	55%	0.551	44%	0.438	S	S	*	.			trans	-106.3	133.4	-179.5	-149.5	160.5	20.4	0	0	112.3	S158	Q154-S158 WeakPolarHBondContact CB-OG 3.3Å; Q154-S158 VanDerWaalsContact CG-OG 3.28Å; Q154-S158 WeakPolarHBondContact CG-OG 3.41Å; Q154-S158 PolarHBondContact OE1-OG 2.9Å
155	A	41.3	Very low	62.8	Low	69 Å²	69	83.5 Å²	83.5	57%	0.57	46%	0.455	S	S	*	.			trans	-54.7	153.7	177.8	0	0	0	0	0	111.6	A157 S158	A155-A157 PolarHBondContact O-N 2.92Å; A155-S158 PolarHBondContact O-N 3.05Å; A155-S158 PolarHBondContact O-OG 3.16Å
156	P	47.8	Very low	63	Low	129 Å²	129	81.9 Å²	81.9	84%	0.838	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	13.6	-174.3	22.9	-33.3	0	0	0	116.6
157	A	43.9	Very low	63.4	Low	85 Å²	85	82.4 Å²	82.4	70%	0.702	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.2	2.5	176.5	0	0	0	0	0	114.4	A155 W159	A155-A157 PolarHBondContact O-N 2.92Å; A157-W159 VanDerWaalsContact C-N 3.31Å; A157-W159 PolarHBondContact O-N 2.96Å
158	S	44.8	Very low	64.2	Low	38 Å²	38	81.7 Å²	81.7	27%	0.266	45%	0.451	S	S	.	.			trans	-86.4	74.6	168.2	54.7	0	0	0	0	110.1	Q154 A155 G160	Q154-S158 WeakPolarHBondContact CB-OG 3.3Å; Q154-S158 VanDerWaalsContact CG-OG 3.28Å; Q154-S158 WeakPolarHBondContact CG-OG 3.41Å; Q154-S158 PolarHBondContact OE1-OG 2.9Å; A155-S158 PolarHBondContact O-N 3.05Å; A155-S158 PolarHBondContact O-OG 3.16Å; S158-G160 PolarHBondContact O-N 2.95Å
159	W	51.5	Low	64.8	Low	180 Å²	180	78.1 Å²	78.1	68%	0.682	44%	0.438	S	S	*	.			trans	-66.5	115	175	-66.6	-19.1	0	0	0	109.4	R145 A157	R145-W159 VanDerWaalsContact NH2-CG 3.3Å; A157-W159 VanDerWaalsContact C-N 3.31Å; A157-W159 PolarHBondContact O-N 2.96Å
160	G	57.5	Low	65.2	Low	10 Å²	10	76 Å²	76	10%	0.103	44%	0.44	C	S	.	.			trans	-55.6	169.1	166.2	0	0	0	0	0	111.6	S158 V162	S158-G160 PolarHBondContact O-N 2.95Å; G160-V162 WeakPolarHBondContact O-CG2 3.35Å; G160-V162 PolarHBondContact O-N 3.1Å
161	P	64.8	Low	65	Low	20 Å²	20	75.2 Å²	75.2	13%	0.13	44%	0.436	C	S	.	.			trans	-62.3	131.8	-170.4	29.2	-36.4	0	0	0	110.8	T51 D52 D53	T51-P161 HydrophobicContact CG2-CG 4.05Å; T51-P161 VanDerWaalsContact OG1-CB 3.3Å; T51-P161 WeakPolarHBondContact OG1-CB 3.17Å; D52-P161 WeakPolarHBondContact O-CB 3.01Å; D53-P161 HydrophobicContact CB-CB 4.38Å; D53-P161 HydrophobicContact CB-CG 4.41Å
162	V	82.6	Confident	64.8	Low	32 Å²	32	80.6 Å²	80.6	19%	0.194	45%	0.453	C	S	.	.			trans	-107.7	-14.2	-170.9	-167	0	0	0	0	111.4	V134 P143 R145 G160	V134-V162 HydrophobicContact CG1-CG1 4.25Å; P143-V162 HydrophobicContact CB-CG1 3.25Å; P143-V162 HydrophobicContact CG-CG1 3.45Å; P143-V162 VanDerWaalsContact CG-CG1 3.45Å; R145-V162 HydrophobicContact CG-CG2 4.2Å; G160-V162 WeakPolarHBondContact O-CG2 3.35Å; G160-V162 PolarHBondContact O-N 3.1Å
163	R	91	Very high	64.3	Low	64 Å²	64	82 Å²	82	24%	0.242	45%	0.448	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	144.3	-176.5	71.6	175.4	-174.5	-94.9	-10.6	109.5	T51 D52 L128 D130 Y132 N133 V134	T51-R163 WeakPolarHBondContact CB-O 3.19Å; T51-R163 PolarHBondContact OG1-O 3.43Å; D52-R163 PolarHBondContact O-NH2 2.87Å; D52-R163 IonicContact OD1-CZ 3.75Å; D52-R163 IonicContact OD1-NE 3.24Å; D52-R163 IonicContact OD1-NH2 3.86Å; D52-R163 PolarHBondContact OD1-NH2 3.37Å; L128-R163 HydrophobicContact CD1-CB 3.91Å; D130-R163 WeakPolarHBondContact OD2-CD 3.48Å; D130-R163 IonicContact OD2-NE 3Å; Y132-R163 HydrophobicContact CD1-CB 4.26Å; Y132-R163 HydrophobicContact CD1-CG 3.76Å; Y132-R163 HydrophobicContact CE1-CG 4.46Å; Y132-R163 HydrophobicContact CG-CB 4.3Å; Y132-R163 HydrophobicContact CG-CG 4.02Å; N133-R163 CarbonylContact O-C 3.57Å; N133-R163 WeakPolarHBondContact O-CA 3.47Å; V134-R163 HydrophobicContact CG2-CB 4.41Å
164	F	94.5	Very high	63.7	Low	0 Å²	0	79.6 Å²	79.6	0%	0	44%	0.442	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	136.8	-177.1	-63.3	-93.7	0	0	0	110.4	L49 Y50 T51 L61 N133 Y135 L144 L146 P166	L49-F164 HydrophobicContact CB-CB 4.31Å; L49-F164 HydrophobicContact CB-CD1 3.92Å; L49-F164 HydrophobicContact CB-CG 4.39Å; L49-F164 HydrophobicContact CD2-CB 4.3Å; Y50-F164 CarbonylContact O-C 3.6Å; Y50-F164 WeakPolarHBondContact O-CA 3.4Å; T51-F164 HydrophobicContact CG2-CD1 4.28Å; T51-F164 HydrophobicContact CG2-CE1 4.02Å; L61-F164 HydrophobicContact CD1-CE1 4.48Å; N133-F164 PolarHBondContact N-O 3.08Å; N133-F164 PolarHBondContact O-N 3.1Å; Y135-F164 HydrophobicContact CD2-CB 4.39Å; Y135-F164 AromaticContact CD2-CD2 3.99Å; Y135-F164 HydrophobicContact CD2-CD2 3.99Å; Y135-F164 HydrophobicContact CD2-CG 4.43Å; Y135-F164 HydrophobicContact CE2-CB 3.95Å; Y135-F164 HydrophobicContact CE2-CD2 4.4Å; Y135-F164 HydrophobicContact CE2-CG 4.42Å; L144-F164 HydrophobicContact CB-CE2 3.87Å; L144-F164 HydrophobicContact CB-CZ 4.3Å; L146-F164 HydrophobicContact CD1-CE1 4.04Å; L146-F164 HydrophobicContact CG-CE1 4.06Å; L146-F164 HydrophobicContact CG-CZ 4.15Å; F164-P166 WeakPolarHBondContact O-CD 3.25Å
165	L	94.6	Very high	63.3	Low	65 Å²	65	82.6 Å²	82.6	34%	0.34	46%	0.456	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	116.1	169.9	-172.5	65.6	0	0	0	109	Y50 Y132 V167	Y50-L165 HydrophobicContact CD1-CB 4.06Å; Y50-L165 HydrophobicContact CD1-CD2 4.41Å; Y50-L165 PolarHBondContact N-O 2.67Å; Y50-L165 PolarHBondContact O-N 2.92Å; Y132-L165 HydrophobicContact CD1-CB 3.92Å; Y132-L165 HydrophobicContact CE1-CB 3.84Å; L165-V167 HydrophobicContact CD2-CG2 4.2Å; L165-V167 HydrophobicContact CG-CG2 4.18Å; L165-V167 PolarHBondContact O-N 3.43Å
166	P	94.2	Very high	63.1	Low	30 Å²	30	87.4 Å²	87.4	20%	0.195	47%	0.466	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	89.6	177.8	30.5	-34	0	0	0	111	R47 L49 F164	R47-P166 HydrophobicContact CB-CB 4.29Å; R47-P166 HydrophobicContact CG-CB 4.14Å; L49-P166 HydrophobicContact CD2-CB 3.99Å; F164-P166 WeakPolarHBondContact O-CD 3.25Å
167	V	93.8	Very high	62.8	Low	26 Å²	26	87.1 Å²	87.1	16%	0.158	46%	0.457	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	135.4	-178.7	-169.1	0	0	0	0	110.4	R47 H48 R75 L165 G169	R47-V167 CarbonylContact C-O 3.57Å; R47-V167 WeakPolarHBondContact CA-O 3.42Å; R47-V167 WeakPolarHBondContact CD-O 3.3Å; H48-V167 PolarHBondContact N-O 3.15Å; H48-V167 PolarHBondContact O-N 3Å; R75-V167 VanDerWaalsContact NH2-CG1 3.33Å; L165-V167 HydrophobicContact CD2-CG2 4.2Å; L165-V167 HydrophobicContact CG-CG2 4.18Å; L165-V167 PolarHBondContact O-N 3.43Å; V167-G169 PolarHBondContact O-N 2.75Å
168	P	90.5	Very high	62.8	Low	66 Å²	66	89 Å²	89	43%	0.429	46%	0.462	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-50.9	125.2	175.6	-29.5	36.8	0	0	0	113.3	L170	P168-L170 PolarHBondContact O-N 3.38Å; P168-L170 VanDerWaalsContact O-N 3.1Å
169	G	78.4	Confident	62.9	Low	12 Å²	12	89.5 Å²	89.5	12%	0.124	47%	0.474	C	S	.	.			trans	-72.5	96.5	162.1	0	0	0	0	0	107.3	H46 V167 L171	H46-G169 PolarHBondContact O-N 2.97Å; H46-G169 VanDerWaalsContact O-N 3.16Å; V167-G169 PolarHBondContact O-N 2.75Å; G169-L171 PolarHBondContact O-N 2.87Å
170	L	66.4	Low	62.3	Low	150 Å²	150	90 Å²	90	79%	0.785	48%	0.481	S	S	*	.			trans	-62.2	112	165.1	-79.2	165	0	0	0	105.6	P168 H172	P168-L170 PolarHBondContact O-N 3.38Å; P168-L170 VanDerWaalsContact O-N 3.1Å; L170-H172 PolarHBondContact O-N 3.36Å
171	L	44.7	Very low	61.8	Low	127 Å²	127	97 Å²	97	67%	0.665	52%	0.515	S	S	*	.			trans	-51.3	120.1	163.5	-65.7	175.9	0	0	0	105	G169 Q173	G169-L171 PolarHBondContact O-N 2.87Å; L171-Q173 PolarHBondContact O-N 2.94Å
172	H	43.1	Very low	61.3	Low	177 Å²	177	100 Å²	100	82%	0.819	54%	0.542	S	S	*	.			trans	-49.5	114.2	145.9	-87.9	43.7	0	0	0	103.5	L170	L170-H172 PolarHBondContact O-N 3.36Å
173	Q	34.9	Very low	60.2	Low	161 Å²	161	104.4 Å²	104.4	75%	0.752	57%	0.571	S	S	*	*			trans	-29.4	129.4	163.7	-149.5	166.3	-30.1	0	0	106.6	L171 Q175	L171-Q173 PolarHBondContact O-N 2.94Å; Q173-Q175 PolarHBondContact O-N 2.72Å
174	P	34.5	Very low	58.9	Low	113 Å²	113	109 Å²	109	73%	0.734	60%	0.595	S	S	*	*			trans	-39.7	118.7	-179.2	-25.5	30.6	0	0	0	106.1	E176	P174-E176 VanDerWaalsContact C-N 3.29Å; P174-E176 PolarHBondContact O-N 2.77Å
175	Q	35.6	Very low	57.7	Low	181 Å²	181	113.4 Å²	113.4	85%	0.846	62%	0.623	S	S	*	*			trans	-45	113.1	176	-80.5	-175.6	-75.1	0	0	103.6	Q173 L177	Q173-Q175 PolarHBondContact O-N 2.72Å; Q175-L177 PolarHBondContact O-N 2.95Å
176	E	36.9	Very low	56.4	Low	169 Å²	169	114.3 Å²	114.3	79%	0.79	63%	0.633	S	S	*	*			trans	-59.1	101.1	-177.8	-167.4	165.8	-175.5	0	0	102.3	P174	P174-E176 VanDerWaalsContact C-N 3.29Å; P174-E176 PolarHBondContact O-N 2.77Å
177	L	40.5	Very low	55.4	Low	124 Å²	124	117.7 Å²	117.7	65%	0.649	65%	0.65	S	S	*	*			trans	-46.5	124.4	175.1	-87.8	150.8	0	0	0	103.5	Q175 G179	Q175-L177 PolarHBondContact O-N 2.95Å; L177-G179 WeakPolarHBondContact O-CA 3.36Å; L177-G179 PolarHBondContact O-N 3.29Å
178	P	44.1	Very low	54.3	Low	124 Å²	124	122.8 Å²	122.8	81%	0.805	68%	0.681	S	S	*	*	S	Bend	trans	-46.5	116.9	-170.5	16.4	-29.4	0	0	0	107.4	F180	P178-F180 PolarHBondContact O-N 2.74Å
179	G	46.5	Very low	53.5	Low	49 Å²	49	122.9 Å²	122.9	51%	0.505	69%	0.694	S	S	.	*			trans	-33.7	128.9	-145.3	0	0	0	0	0	114.6	L177 L181	L177-G179 WeakPolarHBondContact O-CA 3.36Å; L177-G179 PolarHBondContact O-N 3.29Å; G179-L181 PolarHBondContact O-N 2.79Å
180	F	39.8	Very low	53.4	Low	189 Å²	189	124.8 Å²	124.8	83%	0.829	71%	0.705	S	S	*	*			trans	-61.4	89	143.3	-82.5	-83.6	0	0	0	105.6	P178 A182	P178-F180 PolarHBondContact O-N 2.74Å; F180-A182 PolarHBondContact O-N 3.45Å; F180-A182 VanDerWaalsContact O-N 3.16Å
181	L	46.9	Very low	53.8	Low	158 Å²	158	124.1 Å²	124.1	83%	0.827	71%	0.713	S	S	*	*			trans	-46.6	126.8	163.6	-68.6	172.7	0	0	0	105.1	G179	G179-L181 PolarHBondContact O-N 2.79Å
182	A	53.4	Low	55.2	Low	84 Å²	84	120.1 Å²	120.1	69%	0.694	69%	0.692	S	S	*	*			trans	-45.7	133.2	169	0	0	0	0	0	107.2	F180 E184	F180-A182 PolarHBondContact O-N 3.45Å; F180-A182 VanDerWaalsContact O-N 3.16Å; A182-E184 PolarHBondContact O-N 3.18Å; A182-E184 VanDerWaalsContact O-N 3.11Å
183	P	60.5	Low	56.4	Low	123 Å²	123	114.2 Å²	114.2	80%	0.799	67%	0.67	S	S	*	*	P	Polyproline II helix	trans	-50.7	127.7	-179.7	18	-28.9	0	0	0	108.2
184	E	63.3	Low	58.1	Low	162 Å²	162	112.7 Å²	112.7	76%	0.757	67%	0.666	S	S	*	*	P	Polyproline II helix	trans	-52.8	135.3	177	-134.2	-94.2	137.9	0	0	107.4	A182	A182-E184 PolarHBondContact O-N 3.18Å; A182-E184 VanDerWaalsContact O-N 3.11Å
185	P	69.1	Low	59.7	Low	91 Å²	91	111.8 Å²	111.8	59%	0.591	66%	0.662	S	S	*	*	P	Polyproline II helix	trans	-52.3	139.8	-178.5	18.9	-30.7	0	0	0	110.1	D187	P185-D187 PolarHBondContact O-N 2.8Å
186	P	67.1	Low	61.2	Low	84 Å²	84	110.7 Å²	110.7	55%	0.545	66%	0.659	S	S	.	*	P	Polyproline II helix	trans	-56.7	127.2	-174.5	19.8	-31	0	0	0	110.8	V188 P193	P186-V188 PolarHBondContact O-N 3.24Å; P186-P193 WeakPolarHBondContact CB-O 3.33Å
187	D	73.1	Confident	62.6	Low	102 Å²	102	107.8 Å²	107.8	55%	0.545	65%	0.653	S	S	.	*			trans	-68.5	97.6	174.8	179.3	8.2	0	0	0	109.5	P185 G189 S190 P193	P185-D187 PolarHBondContact O-N 2.8Å; D187-G189 PolarHBondContact O-N 3.41Å; D187-G189 VanDerWaalsContact O-N 3.16Å; D187-G189 WeakPolarHBondContact OD1-CA 3.39Å; D187-G189 PolarHBondContact OD1-N 2.89Å; D187-S190 VanDerWaalsContact O-CB 3.24Å; D187-S190 WeakPolarHBondContact O-CB 3.23Å; D187-S190 PolarHBondContact O-N 3.43Å; D187-P193 WeakPolarHBondContact O-CA 3.45Å; D187-P193 WeakPolarHBondContact O-CB 3.5Å
188	V	71.5	Confident	63.5	Low	133 Å²	133	103.7 Å²	103.7	81%	0.806	64%	0.641	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.6	-13.5	179	-61.8	0	0	0	0	113.4	P186	P186-V188 PolarHBondContact O-N 3.24Å
189	G	73.2	Confident	64.2	Low	68 Å²	68	103.2 Å²	103.2	70%	0.701	64%	0.637	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.2	-9.9	173.9	0	0	0	0	0	113.8	D187	D187-G189 PolarHBondContact O-N 3.41Å; D187-G189 VanDerWaalsContact O-N 3.16Å; D187-G189 WeakPolarHBondContact OD1-CA 3.39Å; D187-G189 PolarHBondContact OD1-N 2.89Å
190	S	75.4	Confident	64.3	Low	52 Å²	52	108.8 Å²	108.8	36%	0.364	65%	0.654	S	S	.	*	S	Bend	trans	-72.7	151.1	176.5	179.1	0	0	0	0	111.5	D187 D192 P193	D187-S190 VanDerWaalsContact O-CB 3.24Å; D187-S190 WeakPolarHBondContact O-CB 3.23Å; D187-S190 PolarHBondContact O-N 3.43Å; S190-D192 PolarHBondContact O-N 3.35Å; S190-D192 PolarHBondContact OG-N 3.18Å; S190-D192 VanDerWaalsContact OG-N 3.17Å; S190-P193 WeakPolarHBondContact O-CD 3.18Å
191	S	76.3	Confident	65	Low	135 Å²	135	108.1 Å²	108.1	94%	0.944	65%	0.654	S	S	*	*	S	Bend	trans	-68.8	-17.5	171.1	-51	0	0	0	0	112.9
192	D	72.9	Confident	65.3	Low	44 Å²	44	103.7 Å²	103.7	24%	0.235	65%	0.646	C	S	.	*	S	Bend	trans	-128.9	76	171.5	-174.9	8.1	0	0	0	109.4	S190 L194 S195 M196 V197	S190-D192 PolarHBondContact O-N 3.35Å; S190-D192 PolarHBondContact OG-N 3.18Å; S190-D192 VanDerWaalsContact OG-N 3.17Å; D192-L194 PolarHBondContact O-N 3.19Å; D192-L194 VanDerWaalsContact O-N 3.12Å; D192-S195 PolarHBondContact O-N 3.3Å; D192-S195 VanDerWaalsContact O-N 3.15Å; D192-S195 PolarHBondContact OD1-N 2.99Å; D192-S195 VanDerWaalsContact OD2-C 3.26Å; D192-S195 VanDerWaalsContact OD2-CA 3.25Å; D192-S195 WeakPolarHBondContact OD2-CA 3.28Å; D192-M196 PolarHBondContact OD1-N 3.18Å; D192-M196 VanDerWaalsContact OD1-N 3.16Å; D192-M196 PolarHBondContact OD2-N 3.42Å; D192-V197 PolarHBondContact OD2-N 3.2Å
193	P	69.7	Low	64.8	Low	53 Å²	53	110.9 Å²	110.9	34%	0.344	66%	0.656	S	S	.	*	T	Hydrogen-bonded Turn	trans	-67.9	-11.2	-175.5	28.3	-34.1	0	0	0	112.7	P186 D187 S190	P186-P193 WeakPolarHBondContact CB-O 3.33Å; D187-P193 WeakPolarHBondContact O-CA 3.45Å; D187-P193 WeakPolarHBondContact O-CB 3.5Å; S190-P193 WeakPolarHBondContact O-CD 3.18Å
194	L	69.8	Low	64.1	Low	128 Å²	128	110.4 Å²	110.4	67%	0.67	66%	0.655	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.7	1.7	178.5	-59.8	-178.7	0	0	0	112.9	D192 M196	D192-L194 PolarHBondContact O-N 3.19Å; D192-L194 VanDerWaalsContact O-N 3.12Å; L194-M196 HydrophobicContact CB-CG 3.72Å; L194-M196 PolarHBondContact O-N 3.37Å; L194-M196 VanDerWaalsContact O-N 3.07Å
195	S	67.2	Low	63.4	Low	94 Å²	94	108.3 Å²	108.3	66%	0.657	66%	0.656	S	S	*	*			trans	47.6	34.2	-177	-75.3	0	0	0	0	114	D192 V197 G198	D192-S195 PolarHBondContact O-N 3.3Å; D192-S195 VanDerWaalsContact O-N 3.15Å; D192-S195 PolarHBondContact OD1-N 2.99Å; D192-S195 VanDerWaalsContact OD2-C 3.26Å; D192-S195 VanDerWaalsContact OD2-CA 3.25Å; D192-S195 WeakPolarHBondContact OD2-CA 3.28Å; S195-V197 PolarHBondContact O-N 2.69Å; S195-G198 PolarHBondContact O-N 3.46Å
196	M	68.3	Low	62.7	Low	158 Å²	158	109.4 Å²	109.4	78%	0.778	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.1	-17	-175.6	-68.4	-69.4	-71.1	0	0	112.4	D192 L194	D192-M196 PolarHBondContact OD1-N 3.18Å; D192-M196 VanDerWaalsContact OD1-N 3.16Å; D192-M196 PolarHBondContact OD2-N 3.42Å; L194-M196 HydrophobicContact CB-CG 3.72Å; L194-M196 PolarHBondContact O-N 3.37Å; L194-M196 VanDerWaalsContact O-N 3.07Å
197	V	66.8	Low	61.6	Low	109 Å²	109	116.5 Å²	116.5	66%	0.661	68%	0.683	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92	-15.8	-179.7	-173.2	0	0	0	0	111.8	D192 S195	D192-V197 PolarHBondContact OD2-N 3.2Å; S195-V197 PolarHBondContact O-N 2.69Å
198	G	59.5	Low	60.2	Low	38 Å²	38	116.3 Å²	116.3	39%	0.392	70%	0.696	S	S	.	*			trans	57.2	167.9	-173.3	0	0	0	0	0	112.8	S195 L200	S195-G198 PolarHBondContact O-N 3.46Å; G198-L200 PolarHBondContact O-N 2.97Å
199	P	57	Low	59.1	Low	114 Å²	114	119.2 Å²	119.2	74%	0.74	72%	0.722	S	S	*	*			trans	-64.7	124.9	169.5	20.8	-21.5	0	0	0	108.4	Q201	P199-Q201 PolarHBondContact O-N 2.98Å
200	L	50.3	Low	58.4	Low	165 Å²	165	121.8 Å²	121.8	86%	0.864	72%	0.723	S	S	*	*			trans	-61.5	80.4	168.8	-103.3	154.2	0	0	0	108.7	G198 G202	G198-L200 PolarHBondContact O-N 2.97Å; L200-G202 PolarHBondContact O-N 3.28Å
201	Q	52.8	Low	57.5	Low	175 Å²	175	125.4 Å²	125.4	82%	0.818	74%	0.742	S	S	*	*			trans	-80.4	72.4	171.3	-142.9	132.9	28.4	0	0	107	P199 R203	P199-Q201 PolarHBondContact O-N 2.98Å; Q201-R203 VanDerWaalsContact C-N 3.29Å; Q201-R203 PolarHBondContact O-N 3.35Å
202	G	53.2	Low	56.4	Low	65 Å²	65	124.9 Å²	124.9	67%	0.67	73%	0.731	S	S	*	*			trans	-65.5	87.5	174.9	0	0	0	0	0	110.2	L200	L200-G202 PolarHBondContact O-N 3.28Å
203	R	43.3	Very low	55.5	Low	236 Å²	236	129.6 Å²	129.6	89%	0.891	76%	0.76	S	S	*	*			trans	-140.4	85.9	157.7	-74.5	-167.3	173.1	-171.8	-2.7	108.9	Q201	Q201-R203 VanDerWaalsContact C-N 3.29Å; Q201-R203 PolarHBondContact O-N 3.35Å
204	S	46.1	Very low	54.6	Low	112 Å²	112	134.4 Å²	134.4	78%	0.783	79%	0.786	S	S	*	*			trans	-61.6	133	162.1	-56.9	0	0	0	0	109.2	S206	S204-S206 PolarHBondContact O-N 2.85Å; S204-S206 VanDerWaalsContact O-N 3.17Å
205	P	49.4	Very low	53.6	Low	119 Å²	119	134.9 Å²	134.9	77%	0.773	79%	0.793	S	S	*	*			trans	-75.5	104.6	170.6	29.1	-28.5	0	0	0	108.3	Y207	P205-Y207 PolarHBondContact O-N 3.04Å
206	S	53.3	Low	52.6	Low	114 Å²	114	137.8 Å²	137.8	80%	0.797	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-68.4	124	167.1	38.8	0	0	0	0	109.6	S204 A208	S204-S206 PolarHBondContact O-N 2.85Å; S204-S206 VanDerWaalsContact O-N 3.17Å; S206-A208 PolarHBondContact O-N 3.13Å
207	Y	44.4	Very low	51.4	Low	232 Å²	232	136.2 Å²	136.2	91%	0.91	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-60.4	123.1	169.7	-84.2	-101.6	0	0	0	109.7	P205	P205-Y207 PolarHBondContact O-N 3.04Å
208	A	43.7	Very low	50.1	Low	99 Å²	99	138.5 Å²	138.5	82%	0.818	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-84.6	130.6	164.9	0	0	0	0	0	108.9	S206	S206-A208 PolarHBondContact O-N 3.13Å
209	S	48.3	Very low	49.3	Very low	193 Å²	193	147.6 Å²	147.6	100%	1.35	86%	0.856	S	S	*	*			trans	-82.5	0	165.3	-59	0	0	0	0	110.8

Retrieved 209 of 209 residues in 51.6 ms (Link to these results)

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